N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride

C16H33ClN2O — CID 119608509

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride
SMILESCC(CC(=O)NC(C)(CN)C(C)C)C1CCCCC1.Cl
InChIInChI=1S/C16H32N2O.ClH/c1-12(2)16(4,11-17)18-15(19)10-13(3)14-8-6-5-7-9-14;/h12-14H,5-11,17H2,1-4H3,(H,18,19);1H
InChIKeyLZFRCEPEDDUFLA-UHFFFAOYSA-N
MW304.91 g/mol
LogP3.50
Rot. Bonds6

About N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride

N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride (PubChem CID 119608509) has the molecular formula C16H33ClN2O and a molecular weight of 304.91 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride
PubChem CID119608509
Molecular FormulaC16H33ClN2O
Molecular Weight304.91 g/mol
Exact Mass304.23
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride
SMILESCC(CC(=O)NC(C)(CN)C(C)C)C1CCCCC1.Cl
InChIInChI=1S/C16H32N2O.ClH/c1-12(2)16(4,11-17)18-15(19)10-13(3)14-8-6-5-7-9-14;/h12-14H,5-11,17H2,1-4H3,(H,18,19);1H
InChIKeyLZFRCEPEDDUFLA-UHFFFAOYSA-N
XLogP3.50
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.91
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-2-cyclopropylpropan-2-yl)-3-cyclohexylbutanamide;hydrochloride
CID 119575449
N-(1-amino-2,3-dimethylbutan-2-yl)-2-cyclobutylacetamide;hydrochloride
CID 119606072
N-(1-amino-2,3-dimethylbutan-2-yl)-2-cyclopentylsulfonylacetamide;hydrochloride
CID 119606077
N-(3-aminopropyl)-3-cyclohexylbutanamide;hydrochloride
CID 119408410
3-cyclohexyl-N-[2-(methylamino)ethyl]butanamide;hydrochloride
CID 119503732
N-(1-amino-2,3-dimethylbutan-2-yl)-3-ethyl-4-methylpentanamide;hydrochloride
CID 119605747
N-(1-amino-2,3-dimethylbutan-2-yl)-4-(cyclopentanecarbonylamino)cyclohexane-1-carboxamide
CID 119608044
N-(1-amino-2,3-dimethylbutan-2-yl)-2-pyrrolidin-2-ylacetamide
CID 122080717
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 104622515
1-acetyl-N-(1-amino-2,3-dimethylbutan-2-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119605429
3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide;hydrochloride
CID 120650988
N-(1-amino-2,3-dimethylbutan-2-yl)-5-oxopyrrolidine-2-carboxamide
CID 81487399

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride (CID 119608509) is N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride is CC(CC(=O)NC(C)(CN)C(C)C)C1CCCCC1.Cl.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride?
The InChIKey is LZFRCEPEDDUFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O.ClH/c1-12(2)16(4,11-17)18-15(19)10-13(3)14-8-6-5-7-9-14;/h12-14H,5-11,17H2,1-4H3,(H,18,19);1H.
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride?
N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride has a molecular weight of 304.91 g/mol, XLogP of 3.50, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)-3-cyclohexylbutanamide;hydrochloride is sourced from PubChem (CID 119608509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).