1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide

C14H26N2O — CID 71236000

IUPAC1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide
SMILESCCC(C)C1CCC(NC(=O)C2(N)CC2)CC1
InChIInChI=1S/C14H26N2O/c1-3-10(2)11-4-6-12(7-5-11)16-13(17)14(15)8-9-14/h10-12H,3-9,15H2,1-2H3,(H,16,17)
InChIKeyJZUJVRAUJFXTFJ-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.20
Rot. Bonds4

About 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide

1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide (PubChem CID 71236000) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide
PubChem CID71236000
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide
SMILESCCC(C)C1CCC(NC(=O)C2(N)CC2)CC1
InChIInChI=1S/C14H26N2O/c1-3-10(2)11-4-6-12(7-5-11)16-13(17)14(15)8-9-14/h10-12H,3-9,15H2,1-2H3,(H,16,17)
InChIKeyJZUJVRAUJFXTFJ-UHFFFAOYSA-N
XLogP2.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-(4-propan-2-ylcyclohexyl)cyclohexane-1-carboxamide
CID 119339856
1-amino-N-(4-propan-2-ylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119339847
1-amino-N-(4-aminocyclohexyl)cyclopropane-1-carboxamide
CID 65466451
1-(aminomethyl)-N-(4-propan-2-ylcyclohexyl)cyclopropane-1-carboxamide
CID 71234398
ethyl 4-[(1-aminocyclopentanecarbonyl)amino]cyclohexane-1-carboxylate
CID 60945314
1-amino-N-[1-(3-methylbutanoyl)piperidin-4-yl]cyclopentane-1-carboxamide
CID 119307388
1-amino-N-[1-(2-methylpropyl)piperidin-4-yl]cyclopentane-1-carboxamide;dihydrochloride
CID 119841090
ethyl 4-[(1-aminocyclohexanecarbonyl)amino]cyclohexane-1-carboxylate;hydrochloride
CID 119297447
cis-(1R,3S)-3-[(1-aminocyclopropanecarbonyl)amino]cyclopentane-1-carboxylic acid
CID 106322800
1-amino-N-(1-tert-butylpiperidin-4-yl)cyclopropane-1-carboxamide
CID 65465095
1-amino-N-(3,5-dimethylcyclohexyl)cyclopropane-1-carboxamide
CID 65458422
1-amino-N-(1-cyclopropylpropan-2-yl)cyclopropane-1-carboxamide
CID 65457255

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide (CID 71236000) is 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide is CCC(C)C1CCC(NC(=O)C2(N)CC2)CC1.
What is the InChIKey of 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide?
The InChIKey is JZUJVRAUJFXTFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-10(2)11-4-6-12(7-5-11)16-13(17)14(15)8-9-14/h10-12H,3-9,15H2,1-2H3,(H,16,17).
What are the key properties of 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide?
1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(4-butan-2-ylcyclohexyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 71236000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).