phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate

C17H20N2O2 — CID 60676334

IUPACphenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate
SMILESCN(C)CC(NC(=O)Oc1ccccc1)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-19(2)13-16(14-9-5-3-6-10-14)18-17(20)21-15-11-7-4-8-12-15/h3-12,16H,13H2,1-2H3,(H,18,20)
InChIKeyJXKDOHVJYHLVFT-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.08
Rot. Bonds5

About phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate

phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate (PubChem CID 60676334) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate.

Molecular Properties

Compound Namephenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate
PubChem CID60676334
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Namephenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate
SMILESCN(C)CC(NC(=O)Oc1ccccc1)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-19(2)13-16(14-9-5-3-6-10-14)18-17(20)21-15-11-7-4-8-12-15/h3-12,16H,13H2,1-2H3,(H,18,20)
InChIKeyJXKDOHVJYHLVFT-UHFFFAOYSA-N
XLogP3.08
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-[2-(dimethylamino)-1-phenylethyl]propanamide
CID 107904840
[2-(phenoxycarbonylamino)-2-phenylethyl] methanesulfonate
CID 142664065
2-amino-N-[2-(dimethylamino)-1-phenylethyl]butanamide
CID 61248731
N-[2-(dimethylamino)-1-phenylethyl]-2-(3,4-dimethylphenoxy)acetamide
CID 24504283
1-[2-(dimethylamino)-1-phenylethyl]-3-(5-methylhexan-2-yl)urea
CID 78881535
N-[2-(dimethylamino)-1-phenylethyl]-2-(3-fluorophenoxy)acetamide
CID 47011877
2-(3-chlorophenoxy)-N-[(1R)-2-(dimethylamino)-1-phenylethyl]acetamide
CID 8937450
2-(4-aminophenyl)-N-[2-(dimethylamino)-1-phenylethyl]acetamide;dihydrochloride
CID 119836132
N-[2-(dimethylamino)-1-phenylethyl]-3-propan-2-yloxypropanamide
CID 86929497
2-(4-chlorophenoxy)-N-[(1R)-2-(dimethylamino)-1-phenylethyl]acetamide
CID 8936319
4-chloro-N-[(1R)-2-(dimethylamino)-1-phenylethyl]benzamide
CID 8936052
3-amino-N-[2-(dimethylamino)-1-phenylethyl]-2-methyl-3-phenylpropanamide
CID 119836141

Frequently Asked Questions

What is the IUPAC name of phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate?
The IUPAC name of phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate (CID 60676334) is phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate.
What is the SMILES notation for phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate?
The canonical SMILES for phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate is CN(C)CC(NC(=O)Oc1ccccc1)c1ccccc1.
What is the InChIKey of phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate?
The InChIKey is JXKDOHVJYHLVFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-19(2)13-16(14-9-5-3-6-10-14)18-17(20)21-15-11-7-4-8-12-15/h3-12,16H,13H2,1-2H3,(H,18,20).
What are the key properties of phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate?
phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate has a molecular weight of 284.36 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-[2-(dimethylamino)-1-phenylethyl]carbamate is sourced from PubChem (CID 60676334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).