2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide

C13H26N2O2 — CID 106188264

IUPAC2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide
SMILESCC(C)(O)C(C)(C)NC(=O)C1CCCCC1N
InChIInChI=1S/C13H26N2O2/c1-12(2,13(3,4)17)15-11(16)9-7-5-6-8-10(9)14/h9-10,17H,5-8,14H2,1-4H3,(H,15,16)
InChIKeyLJEPJFQHNZBMPF-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.17
Rot. Bonds3

About 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide

2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide (PubChem CID 106188264) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide
PubChem CID106188264
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide
SMILESCC(C)(O)C(C)(C)NC(=O)C1CCCCC1N
InChIInChI=1S/C13H26N2O2/c1-12(2,13(3,4)17)15-11(16)9-7-5-6-8-10(9)14/h9-10,17H,5-8,14H2,1-4H3,(H,15,16)
InChIKeyLJEPJFQHNZBMPF-UHFFFAOYSA-N
XLogP1.17
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cycloheptane-1-carboxamide
CID 106188227
methyl 2-[(2-aminocyclopentanecarbonyl)amino]-2-methylpropanoate
CID 64823158
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methylcyclopropane-1-carboxamide
CID 103895464
2-amino-N-(1-hydroxy-2-methylbutan-2-yl)cyclopentane-1-carboxamide
CID 64852632
2-amino-N-[2-(4-bromophenyl)propan-2-yl]cyclohexane-1-carboxamide
CID 64822736
2-amino-N',N'-dimethylcyclohexane-1-carbohydrazide
CID 83021936
(2R)-2-[(2-aminocyclohexanecarbonyl)amino]-3,3-dimethylbutanoic acid
CID 103927341
1-(2-aminocycloheptyl)-2,2-dimethylpropan-1-one
CID 116595247
2-amino-N-cyclopentylcyclohexane-1-carboxamide
CID 62777872
N-[1-(2-aminocyclooctyl)-2-methyl-1-oxobutan-2-yl]cyclooctanecarboxamide
CID 123758150
2-amino-N-propan-2-ylcyclooctane-1-carboxamide;hydrochloride
CID 119668927
2-amino-N-(2,3-dihydroxy-2-methylpropyl)cyclopentane-1-carboxamide
CID 66186728

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide (CID 106188264) is 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide is CC(C)(O)C(C)(C)NC(=O)C1CCCCC1N.
What is the InChIKey of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide?
The InChIKey is LJEPJFQHNZBMPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-12(2,13(3,4)17)15-11(16)9-7-5-6-8-10(9)14/h9-10,17H,5-8,14H2,1-4H3,(H,15,16).
What are the key properties of 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide?
2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide has a molecular weight of 242.36 g/mol, XLogP of 1.17, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-hydroxy-2,3-dimethylbutan-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 106188264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).