1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide

C15H27N3O — CID 79641404

IUPAC1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide
SMILESCN(CC1CC1)C1CCCC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C15H27N3O/c1-18(10-11-4-5-11)13-3-2-8-15(9-13,14(16)19)17-12-6-7-12/h11-13,17H,2-10H2,1H3,(H2,16,19)
InChIKeyNQYAVCNXRIARCU-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.25
Rot. Bonds6

About 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide

1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide (PubChem CID 79641404) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide
PubChem CID79641404
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide
SMILESCN(CC1CC1)C1CCCC(NC2CC2)(C(N)=O)C1
InChIInChI=1S/C15H27N3O/c1-18(10-11-4-5-11)13-3-2-8-15(9-13,14(16)19)17-12-6-7-12/h11-13,17H,2-10H2,1H3,(H2,16,19)
InChIKeyNQYAVCNXRIARCU-UHFFFAOYSA-N
XLogP1.25
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[cyclopropylmethyl(methyl)amino]-1-(ethylamino)cyclohexane-1-carboxamide
CID 79641470
1-(cyclopropylamino)-3-[methyl(oxolan-2-ylmethyl)amino]cyclopentane-1-carboxamide
CID 79655154
3-[cyclohexylmethyl(methyl)amino]-1-(cyclopropylamino)cyclopentane-1-carboxylic acid
CID 79647676
ethyl 3-[cyclopropylmethyl(methyl)amino]-1-(methylamino)cyclohexane-1-carboxylate
CID 79641939
3-[cyclopentylmethyl(methyl)amino]-1-(methylamino)cyclohexane-1-carboxylic acid
CID 79641441
3-[butyl(ethyl)amino]-1-(cyclopropylamino)cyclohexane-1-carboxamide
CID 79636571
3-[cyclopentyl(ethyl)amino]-1-(cyclopropylamino)cyclopentane-1-carboxamide
CID 79655119
3-cyclobutyloxy-1-(cyclopropylamino)cyclohexane-1-carboxamide
CID 79638102
1-(ethylamino)-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]cyclohexane-1-carboxamide
CID 79633998
1-(cyclopropylamino)-3-[cyclopropyl(methyl)amino]cyclohexane-1-carboxylic acid
CID 79635913
1-(cyclopropylamino)cyclooctane-1-carboxamide
CID 60795922
1-(ethylamino)-3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]cyclopentane-1-carboxamide
CID 79644653

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide?
The IUPAC name of 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide (CID 79641404) is 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide is CN(CC1CC1)C1CCCC(NC2CC2)(C(N)=O)C1.
What is the InChIKey of 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide?
The InChIKey is NQYAVCNXRIARCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-18(10-11-4-5-11)13-3-2-8-15(9-13,14(16)19)17-12-6-7-12/h11-13,17H,2-10H2,1H3,(H2,16,19).
What are the key properties of 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide?
1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide has a molecular weight of 265.40 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-[cyclopropylmethyl(methyl)amino]cyclohexane-1-carboxamide is sourced from PubChem (CID 79641404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).