N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide

C17H30N2O2 — CID 2921928

IUPACN-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide
SMILESCC(CNC(=O)C1CCCCC1)NC(=O)C1CCCCC1
InChIInChI=1S/C17H30N2O2/c1-13(19-17(21)15-10-6-3-7-11-15)12-18-16(20)14-8-4-2-5-9-14/h13-15H,2-12H2,1H3,(H,18,20)(H,19,21)
InChIKeyFRJPRYHZVLLJQD-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.77
Rot. Bonds5

About N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide

N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide (PubChem CID 2921928) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide
PubChem CID2921928
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC NameN-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide
SMILESCC(CNC(=O)C1CCCCC1)NC(=O)C1CCCCC1
InChIInChI=1S/C17H30N2O2/c1-13(19-17(21)15-10-6-3-7-11-15)12-18-16(20)14-8-4-2-5-9-14/h13-15H,2-12H2,1H3,(H,18,20)(H,19,21)
InChIKeyFRJPRYHZVLLJQD-UHFFFAOYSA-N
XLogP2.77
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclohexanecarboxamide, N-[(3S)-hexahydro-2-oxo-1H-azepin-3-yl]-
CID 11543222
N,3-dicyclohexylpropanamide
CID 759108
N-[1-({2-[butyl(methyl)amino]ethyl}amino)-3-methyl-1-oxobutan-2-yl]-4-methylcyclohexanecarboxamide
CID 16187659
N,2-dicyclohexylacetamide
CID 880907
N-(cyclohexylmethyl)cyclohexanecarboxamide
CID 4051138
N-(2,2,6,6-tetramethylpiperidin-4-yl)cyclohexanecarboxamide
CID 845135
N-(piperidin-4-yl)cyclohexanecarboxamide
CID 1445167
N-butylcyclohexanecarboxamide
CID 3544722
Proline scaffold, 34
CID 42618131
N-3-fluorobenzoyl-L-leucine-glycine nitrile (21)
CID 127054393
N-2,3-difluorobenzoyl-L-leucine-glycine nitrile (22)
CID 127054394
1-(Formyl-isopropyl-amino)-cyclohexanecarboxylic acid cyclohexylamide
CID 651913

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide (CID 2921928) is N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide is CC(CNC(=O)C1CCCCC1)NC(=O)C1CCCCC1.
What is the InChIKey of N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide?
The InChIKey is FRJPRYHZVLLJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-13(19-17(21)15-10-6-3-7-11-15)12-18-16(20)14-8-4-2-5-9-14/h13-15H,2-12H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide?
N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide has a molecular weight of 294.44 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexanecarbonylamino)propyl]cyclohexanecarboxamide is sourced from PubChem (CID 2921928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).