N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide

C23H34N4O4 — CID 1083884

IUPACN'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide
SMILESCc1cc(NC(=O)CCC(=O)N(C2CC2)C2(C(=O)NC3CCCC3)CCCCC2)no1
InChIInChI=1S/C23H34N4O4/c1-16-15-19(26-31-16)25-20(28)11-12-21(29)27(18-9-10-18)23(13-5-2-6-14-23)22(30)24-17-7-3-4-8-17/h15,17-18H,2-14H2,1H3,(H,24,30)(H,25,26,28)
InChIKeyFMJUVDWWVQRZHX-UHFFFAOYSA-N
MW430.55 g/mol
LogP3.45
Rot. Bonds8

About N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide

N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide (PubChem CID 1083884) has the molecular formula C23H34N4O4 and a molecular weight of 430.55 g/mol. Its IUPAC name is N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide.

Molecular Properties

Compound NameN'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide
PubChem CID1083884
Molecular FormulaC23H34N4O4
Molecular Weight430.55 g/mol
Exact Mass430.26
IUPAC NameN'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide
SMILESCc1cc(NC(=O)CCC(=O)N(C2CC2)C2(C(=O)NC3CCCC3)CCCCC2)no1
InChIInChI=1S/C23H34N4O4/c1-16-15-19(26-31-16)25-20(28)11-12-21(29)27(18-9-10-18)23(13-5-2-6-14-23)22(30)24-17-7-3-4-8-17/h15,17-18H,2-14H2,1H3,(H,24,30)(H,25,26,28)
InChIKeyFMJUVDWWVQRZHX-UHFFFAOYSA-N
XLogP3.45
TPSA104.54 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.55
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide with MolForge

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Related Compounds

N'-[1-(cyclohexylcarbamoyl)-4-methylcyclohexyl]-N-(5-methyl-1,2-oxazol-3-yl)-N'-(thiophen-2-ylmethyl)butanediamide
CID 1083879
N'-[(1S,2S)-1-(cyclohexylcarbamoyl)-2-methylcyclohexyl]-N-(5-methyl-1,2-oxazol-3-yl)-N'-(thiophen-2-ylmethyl)butanediamide
CID 1083876
3-(cycloheptylamino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 109031668
1-cyclododecyl-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 108812118
N'-[2-(cyclopentylamino)-2-oxoethyl]-N'-(3-methylbutyl)-N-(5-methyl-1,2-oxazol-3-yl)butanediamide
CID 3210776
N'-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-N-(5-methyl-1,2-oxazol-3-yl)-N'-phenylbutanediamide
CID 7420004
2-(cyclohexylamino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 813408
N-cyclohexyl-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109014106
N-cyclopentyl-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 44996024
N'-butyl-N'-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(5-methyl-1,2-oxazol-3-yl)butanediamide
CID 3210748
N'-[2-(cyclopentylamino)-2-oxoethyl]-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-methyl-1,2-oxazol-3-yl)butanediamide
CID 650001
1-N-cycloheptyl-4-N-(5-methyl-1,2-oxazol-3-yl)cyclohexane-1,4-dicarboxamide
CID 109149703

Frequently Asked Questions

What is the IUPAC name of N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide?
The IUPAC name of N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide (CID 1083884) is N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide.
What is the SMILES notation for N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide?
The canonical SMILES for N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide is Cc1cc(NC(=O)CCC(=O)N(C2CC2)C2(C(=O)NC3CCCC3)CCCCC2)no1.
What is the InChIKey of N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide?
The InChIKey is FMJUVDWWVQRZHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N4O4/c1-16-15-19(26-31-16)25-20(28)11-12-21(29)27(18-9-10-18)23(13-5-2-6-14-23)22(30)24-17-7-3-4-8-17/h15,17-18H,2-14H2,1H3,(H,24,30)(H,25,26,28).
What are the key properties of N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide?
N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide has a molecular weight of 430.55 g/mol, XLogP of 3.45, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(cyclopentylcarbamoyl)cyclohexyl]-N'-cyclopropyl-N-(5-methyl-1,2-oxazol-3-yl)butanediamide is sourced from PubChem (CID 1083884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).