4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide

C18H24N2O2 — CID 39031356

IUPAC4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide
SMILESCC1CCC(NC(=O)c2ccc(NC(=O)C3CC3)cc2)CC1
InChIInChI=1S/C18H24N2O2/c1-12-2-8-15(9-3-12)19-18(22)14-6-10-16(11-7-14)20-17(21)13-4-5-13/h6-7,10-13,15H,2-5,8-9H2,1H3,(H,19,22)(H,20,21)
InChIKeyDOOJMNZFCMNMNL-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.34
Rot. Bonds4

About 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide

4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide (PubChem CID 39031356) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide.

Molecular Properties

Compound Name4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide
PubChem CID39031356
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide
SMILESCC1CCC(NC(=O)c2ccc(NC(=O)C3CC3)cc2)CC1
InChIInChI=1S/C18H24N2O2/c1-12-2-8-15(9-3-12)19-18(22)14-6-10-16(11-7-14)20-17(21)13-4-5-13/h6-7,10-13,15H,2-5,8-9H2,1H3,(H,19,22)(H,20,21)
InChIKeyDOOJMNZFCMNMNL-UHFFFAOYSA-N
XLogP3.34
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[(4-methylcyclohexyl)amino]phenyl]cyclopropanecarboxamide
CID 28660300
3-[[4-(cyclopropanecarbonylamino)benzoyl]amino]-N-cyclopropylbenzamide
CID 26110757
(2S,4S)-N-[4-(cyclopropylcarbamoyl)phenyl]-2-methylpiperidine-4-carboxamide
CID 120619355
cis-(1S,3R)-3-[[4-[(2-methylcyclopropanecarbonyl)amino]benzoyl]amino]cyclopentane-1-carboxylic acid
CID 120675005
4-(cyclopropanecarbonylamino)-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119453816
N-[4-(cyclopropylcarbamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78982521
N-cyclopropyl-4-(cyclopropylcarbamoylamino)benzamide
CID 17180568
4-N-(4-acetylphenyl)-1-N-cyclopropylbenzene-1,4-dicarboxamide
CID 109043399
N-[4-[(4-methylcyclohexyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 175209394
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(cyclopropanecarbonylamino)benzamide
CID 134047720
6-[[4-(cyclopropylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 42950216
4-[(3-aminocyclohexanecarbonyl)amino]-N-cyclopropylbenzamide;hydrochloride
CID 119698530

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide?
The IUPAC name of 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide (CID 39031356) is 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide.
What is the SMILES notation for 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide?
The canonical SMILES for 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide is CC1CCC(NC(=O)c2ccc(NC(=O)C3CC3)cc2)CC1.
What is the InChIKey of 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide?
The InChIKey is DOOJMNZFCMNMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-12-2-8-15(9-3-12)19-18(22)14-6-10-16(11-7-14)20-17(21)13-4-5-13/h6-7,10-13,15H,2-5,8-9H2,1H3,(H,19,22)(H,20,21).
What are the key properties of 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide?
4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide has a molecular weight of 300.40 g/mol, XLogP of 3.34, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropanecarbonylamino)-N-(4-methylcyclohexyl)benzamide is sourced from PubChem (CID 39031356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).