2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide

C14H28N2O — CID 62783421

IUPAC2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide
SMILESCCC(NC(=O)C1CCCC(C)C1N)C(C)C
InChIInChI=1S/C14H28N2O/c1-5-12(9(2)3)16-14(17)11-8-6-7-10(4)13(11)15/h9-13H,5-8,15H2,1-4H3,(H,16,17)
InChIKeyYMXIHLQSTBORDM-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.30
Rot. Bonds4

About 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide

2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide (PubChem CID 62783421) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide
PubChem CID62783421
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide
SMILESCCC(NC(=O)C1CCCC(C)C1N)C(C)C
InChIInChI=1S/C14H28N2O/c1-5-12(9(2)3)16-14(17)11-8-6-7-10(4)13(11)15/h9-13H,5-8,15H2,1-4H3,(H,16,17)
InChIKeyYMXIHLQSTBORDM-UHFFFAOYSA-N
XLogP2.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(3-ethylpentan-2-yl)-3-methylcyclohexane-1-carboxamide
CID 63841135
N-(1-amino-4-methylpentan-3-yl)-2-methylcyclopentane-1-carboxamide
CID 106356810
2-amino-N-(4-methoxybutan-2-yl)-3-methylcyclohexane-1-carboxamide
CID 64603719
2-amino-3-methyl-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 62776500
2-amino-N,3-dimethylcyclohexane-1-carboxamide
CID 62776522
4-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide
CID 62783259
3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylcyclohexane-1-carboxamide
CID 65053094
cis-(1S,2R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 143706762
4-amino-N-(2-methylpentan-3-yl)cyclopent-2-ene-1-carboxamide
CID 79207896
ethane;(1R)-2-methyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 143679818
2-amino-3-methyl-N-(2,2,3,3-tetrafluoropropyl)cyclohexane-1-carboxamide
CID 114169878
2-(3-methylpentan-2-ylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103978580

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide (CID 62783421) is 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide is CCC(NC(=O)C1CCCC(C)C1N)C(C)C.
What is the InChIKey of 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide?
The InChIKey is YMXIHLQSTBORDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-12(9(2)3)16-14(17)11-8-6-7-10(4)13(11)15/h9-13H,5-8,15H2,1-4H3,(H,16,17).
What are the key properties of 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide?
2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-N-(2-methylpentan-3-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 62783421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).