1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide

C20H34N2O2 — CID 2982201

IUPAC1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
SMILESO=C(NC1CCCCC1)C1CCC(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C20H34N2O2/c23-19(21-17-7-3-1-4-8-17)15-11-13-16(14-12-15)20(24)22-18-9-5-2-6-10-18/h15-18H,1-14H2,(H,21,23)(H,22,24)
InChIKeyNZEOICMEPDOJKB-UHFFFAOYSA-N
MW334.50 g/mol
LogP3.69
Rot. Bonds4

About 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide

1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide (PubChem CID 2982201) has the molecular formula C20H34N2O2 and a molecular weight of 334.50 g/mol. Its IUPAC name is 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
PubChem CID2982201
Molecular FormulaC20H34N2O2
Molecular Weight334.50 g/mol
Exact Mass334.26
IUPAC Name1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide
SMILESO=C(NC1CCCCC1)C1CCC(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C20H34N2O2/c23-19(21-17-7-3-1-4-8-17)15-11-13-16(14-12-15)20(24)22-18-9-5-2-6-10-18/h15-18H,1-14H2,(H,21,23)(H,22,24)
InChIKeyNZEOICMEPDOJKB-UHFFFAOYSA-N
XLogP3.69
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.50
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclodecylcyclododecanecarboxamide
CID 135182352
N-cyclopentylcyclobutanecarboxamide
CID 21158774
N-cyclopropylcycloheptanecarboxamide
CID 62778853
N-cyclopropylcyclohexanecarboxamide
CID 3412875
acetaldehyde;N-cyclohexylcyclopropanecarboxamide
CID 143959717
N-(5-cycloheptylcyclooctyl)cycloheptanecarboxamide
CID 166761294
4-(cyclobutylcarbamoyl)cyclohexane-1-carboxylic acid
CID 63784542
3-(cyclooctylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103549818
N-cycloheptylpiperidine-4-carboxamide;hydrochloride
CID 70702347
N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546
4-(aminomethyl)-N-cyclopentylcyclohexane-1-carboxamide;hydrochloride
CID 165437685

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide?
The IUPAC name of 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide (CID 2982201) is 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide.
What is the SMILES notation for 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide?
The canonical SMILES for 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide is O=C(NC1CCCCC1)C1CCC(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide?
The InChIKey is NZEOICMEPDOJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34N2O2/c23-19(21-17-7-3-1-4-8-17)15-11-13-16(14-12-15)20(24)22-18-9-5-2-6-10-18/h15-18H,1-14H2,(H,21,23)(H,22,24).
What are the key properties of 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide?
1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide has a molecular weight of 334.50 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-dicyclohexylcyclohexane-1,4-dicarboxamide is sourced from PubChem (CID 2982201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).