tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate

C131H144N12O15 — CID 91582619

IUPACtert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate
SMILESCC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCCc1ccccc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCCc1cccnc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCc1ccccc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCc1ccccn1.CCc1ccc(NC(=O)c2ccccc2-c2ccccc2CNC(=O)OC(C)(C)C)cc1
InChIInChI=1S/2C27H30N2O3.C26H29N3O3.C26H28N2O3.C25H27N3O3/c1-27(2,3)32-26(31)29-19-21-13-7-8-14-22(21)23-15-9-10-16-24(23)25(30)28-18-17-20-11-5-4-6-12-20;1-5-19-14-16-21(17-15-19)29-25(30)24-13-9-8-12-23(24)22-11-7-6-10-20(22)18-28-26(31)32-27(2,3)4;1-26(2,3)32-25(31)29-18-20-10-4-5-11-21(20)22-12-6-7-13-23(22)24(30)28-16-14-19-9-8-15-27-17-19;1-26(2,3)31-25(30)28-18-20-13-7-8-14-21(20)22-15-9-10-16-23(22)24(29)27-17-19-11-5-4-6-12-19;1-25(2,3)31-24(30)28-16-18-10-4-5-12-20(18)21-13-6-7-14-22(21)23(29)27-17-19-11-8-9-15-26-19/h4-16H,17-19H2,1-3H3,(H,28,30)(H,29,31);6-17H,5,18H2,1-4H3,(H,28,31)(H,29,30);4-13,15,17H,14,16,18H2,1-3H3,(H,28,30)(H,29,31);4-16H,17-18H2,1-3H3,(H,27,29)(H,28,30);4-15H,16-17H2,1-3H3,(H,27,29)(H,28,30)
InChIKeyCPRWUKAKDBVYGD-UHFFFAOYSA-N
MW2126.66 g/mol
LogP26.30
Rot. Bonds32

About tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate

tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate (PubChem CID 91582619) has the molecular formula C131H144N12O15 and a molecular weight of 2126.66 g/mol. Its IUPAC name is tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate
PubChem CID91582619
Molecular FormulaC131H144N12O15
Molecular Weight2126.66 g/mol
Exact Mass2125.09
IUPAC Nametert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate
SMILESCC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCCc1ccccc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCCc1cccnc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCc1ccccc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCc1ccccn1.CCc1ccc(NC(=O)c2ccccc2-c2ccccc2CNC(=O)OC(C)(C)C)cc1
InChIInChI=1S/2C27H30N2O3.C26H29N3O3.C26H28N2O3.C25H27N3O3/c1-27(2,3)32-26(31)29-19-21-13-7-8-14-22(21)23-15-9-10-16-24(23)25(30)28-18-17-20-11-5-4-6-12-20;1-5-19-14-16-21(17-15-19)29-25(30)24-13-9-8-12-23(24)22-11-7-6-10-20(22)18-28-26(31)32-27(2,3)4;1-26(2,3)32-25(31)29-18-20-10-4-5-11-21(20)22-12-6-7-13-23(22)24(30)28-16-14-19-9-8-15-27-17-19;1-26(2,3)31-25(30)28-18-20-13-7-8-14-21(20)22-15-9-10-16-23(22)24(29)27-17-19-11-5-4-6-12-19;1-25(2,3)31-24(30)28-16-18-10-4-5-12-20(18)21-13-6-7-14-22(21)23(29)27-17-19-11-8-9-15-26-19/h4-16H,17-19H2,1-3H3,(H,28,30)(H,29,31);6-17H,5,18H2,1-4H3,(H,28,31)(H,29,30);4-13,15,17H,14,16,18H2,1-3H3,(H,28,30)(H,29,31);4-16H,17-18H2,1-3H3,(H,27,29)(H,28,30);4-15H,16-17H2,1-3H3,(H,27,29)(H,28,30)
InChIKeyCPRWUKAKDBVYGD-UHFFFAOYSA-N
XLogP26.30
TPSA362.93 Ų
H-Bond Donors10
H-Bond Acceptors17
Rotatable Bonds32
Heavy Atoms158
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002126.66
LogP ≤ 526.30
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate with MolForge

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Related Compounds

benzyl N-[[2-[2-[(5-methyl-2-oxohexan-3-yl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(2-fluoro-4-methylphenyl)methylcarbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate;methane;methyl 3-phenyl-2-[[2-[2-(phenylmethoxycarbonylaminomethyl)phenyl]benzoyl]amino]propanoate
CID 157090694
N-benzyl-2-[2-[[[2-(4-methoxyphenyl)acetyl]amino]methyl]phenyl]benzamide;2-[2-[[3-(4-ethoxyphenyl)propanoylamino]methyl]phenyl]-N-(2-pyridin-2-ylethyl)benzamide;bis(2-[2-[[[2-(4-methoxyphenyl)acetyl]amino]methyl]phenyl]-N-(2-phenylethyl)benzamide);2-[2-[[[2-(4-methoxyphenyl)acetyl]amino]methyl]phenyl]-N-(pyridin-2-ylmethyl)benzamide
CID 123600471
tert-butyl N-[2-[4-(pyridin-2-ylmethylamino)phenyl]ethyl]carbamate
CID 173054324
2-(2-ethylphenyl)-N-(2-pyridin-2-ylethyl)benzamide
CID 142054987
tert-butyl N-[[4-[(2-fluorobenzoyl)amino]phenyl]methyl]carbamate
CID 54015016
tert-butyl N-[[4-[[(2-methylpyridine-3-carbonyl)amino]methyl]phenyl]methyl]carbamate
CID 142274095
tert-butyl N-[[4-[(3-hydroxypyridine-2-carbonyl)amino]phenyl]methyl]carbamate
CID 171505071
N-(pyridin-3-ylmethyl)-2-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 1279662
3-[2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]pyridine-2-carboxylic acid
CID 12017234
2-ethoxy-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 39561652
N-(4-ethylphenyl)-2,2-dimethyl-N'-(pyridin-2-ylmethyl)propanediamide
CID 108963397
tert-butyl N-[[4-[(2,2-diphenylacetyl)amino]phenyl]methyl]carbamate
CID 25186226

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate?
The IUPAC name of tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate (CID 91582619) is tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate.
What is the SMILES notation for tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate?
The canonical SMILES for tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate is CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCCc1ccccc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCCc1cccnc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCc1ccccc1.CC(C)(C)OC(=O)NCc1ccccc1-c1ccccc1C(=O)NCc1ccccn1.CCc1ccc(NC(=O)c2ccccc2-c2ccccc2CNC(=O)OC(C)(C)C)cc1.
What is the InChIKey of tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate?
The InChIKey is CPRWUKAKDBVYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C27H30N2O3.C26H29N3O3.C26H28N2O3.C25H27N3O3/c1-27(2,3)32-26(31)29-19-21-13-7-8-14-22(21)23-15-9-10-16-24(23)25(30)28-18-17-20-11-5-4-6-12-20;1-5-19-14-16-21(17-15-19)29-25(30)24-13-9-8-12-23(24)22-11-7-6-10-20(22)18-28-26(31)32-27(2,3)4;1-26(2,3)32-25(31)29-18-20-10-4-5-11-21(20)22-12-6-7-13-23(22)24(30)28-16-14-19-9-8-15-27-17-19;1-26(2,3)31-25(30)28-18-20-13-7-8-14-21(20)22-15-9-10-16-23(22)24(29)27-17-19-11-5-4-6-12-19;1-25(2,3)31-24(30)28-16-18-10-4-5-12-20(18)21-13-6-7-14-22(21)23(29)27-17-19-11-8-9-15-26-19/h4-16H,17-19H2,1-3H3,(H,28,30)(H,29,31);6-17H,5,18H2,1-4H3,(H,28,31)(H,29,30);4-13,15,17H,14,16,18H2,1-3H3,(H,28,30)(H,29,31);4-16H,17-18H2,1-3H3,(H,27,29)(H,28,30);4-15H,16-17H2,1-3H3,(H,27,29)(H,28,30).
What are the key properties of tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate?
tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate has a molecular weight of 2126.66 g/mol, XLogP of 26.30, 32 rotatable bonds, 10 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[[2-[2-(benzylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-[(4-ethylphenyl)carbamoyl]phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-phenylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(2-pyridin-3-ylethylcarbamoyl)phenyl]phenyl]methyl]carbamate;tert-butyl N-[[2-[2-(pyridin-2-ylmethylcarbamoyl)phenyl]phenyl]methyl]carbamate is sourced from PubChem (CID 91582619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).