3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide

C17H32N2O — CID 60867060

IUPAC3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
SMILESCCC(C)(C)C1CCC(NC(=O)CCNC2CC2)CC1
InChIInChI=1S/C17H32N2O/c1-4-17(2,3)13-5-7-15(8-6-13)19-16(20)11-12-18-14-9-10-14/h13-15,18H,4-12H2,1-3H3,(H,19,20)
InChIKeyCYZMSQKSBSPERY-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.24
Rot. Bonds7

About 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide

3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide (PubChem CID 60867060) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
PubChem CID60867060
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
SMILESCCC(C)(C)C1CCC(NC(=O)CCNC2CC2)CC1
InChIInChI=1S/C17H32N2O/c1-4-17(2,3)13-5-7-15(8-6-13)19-16(20)11-12-18-14-9-10-14/h13-15,18H,4-12H2,1-3H3,(H,19,20)
InChIKeyCYZMSQKSBSPERY-UHFFFAOYSA-N
XLogP3.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
CID 43696457
7-amino-N-[4-(2-methylbutan-2-yl)cyclohexyl]heptanamide
CID 43698547
2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]ethanol
CID 43085230
3-(cyclobutylamino)-N-cyclopropylpropanamide
CID 62627198
methyl 4-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]butanoate
CID 60782419
N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-propan-2-yloxyacetamide
CID 112686677
3-[(4-tert-butylcyclohexyl)amino]-N-propylpropanamide
CID 61060237
3-(2,5-dioxoimidazolidin-4-yl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide
CID 51073460
4-[3-(cyclopropylamino)propanoylamino]cyclohexane-1-carboxylic acid
CID 61161235
N-(2-cyclohexylethyl)-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 63448545
3-(cyclopropylamino)-N-(1-hydroxy-2-methylpropan-2-yl)propanamide
CID 60841584
(2S)-2-amino-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide;hydrochloride
CID 119272259

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
The IUPAC name of 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide (CID 60867060) is 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide is CCC(C)(C)C1CCC(NC(=O)CCNC2CC2)CC1.
What is the InChIKey of 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
The InChIKey is CYZMSQKSBSPERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-4-17(2,3)13-5-7-15(8-6-13)19-16(20)11-12-18-14-9-10-14/h13-15,18H,4-12H2,1-3H3,(H,19,20).
What are the key properties of 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide?
3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide has a molecular weight of 280.46 g/mol, XLogP of 3.24, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-[4-(2-methylbutan-2-yl)cyclohexyl]propanamide is sourced from PubChem (CID 60867060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).