N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride

C13H27ClN2O — CID 119574117

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride
SMILESCCCC(C)CC(=O)NC(C)(CN)C1CC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-4-5-10(2)8-12(16)15-13(3,9-14)11-6-7-11;/h10-11H,4-9,14H2,1-3H3,(H,15,16);1H
InChIKeyHZBJPCDBCXCHSC-UHFFFAOYSA-N
MW262.82 g/mol
LogP2.48
Rot. Bonds7

About N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride

N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride (PubChem CID 119574117) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride
PubChem CID119574117
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride
SMILESCCCC(C)CC(=O)NC(C)(CN)C1CC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-4-5-10(2)8-12(16)15-13(3,9-14)11-6-7-11;/h10-11H,4-9,14H2,1-3H3,(H,15,16);1H
InChIKeyHZBJPCDBCXCHSC-UHFFFAOYSA-N
XLogP2.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.82
LogP ≤ 52.48
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-cyclopropylpropan-2-yl)-N-propan-2-ylpentanediamide;hydrochloride
CID 119573556
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(diethylamino)acetamide
CID 119572571
N-(1-amino-2-cyclopropylpropan-2-yl)-2-cyclopropylpropanamide;hydrochloride
CID 119573506
N-(1-amino-2-cyclopropylpropan-2-yl)acetamide
CID 81486890
N-[1-[(1-amino-2-cyclopropylpropan-2-yl)amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride
CID 119575220
N-(1-amino-2-cyclopropylpropan-2-yl)-2-butoxypropanamide
CID 119575434
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(4-methylpentan-2-yloxy)propanamide
CID 119575565
2-methyl-2-(3-methylhexanoylamino)butanoic acid
CID 119199351
1-(1-amino-2-cyclopropylpropan-2-yl)-3-ethylurea
CID 115307789
N-(1-amino-2-cyclopropylpropan-2-yl)-3-cyclohexylpropanamide
CID 81487027
N-cyclopropyl-3-methylhexanamide
CID 155359047

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride (CID 119574117) is N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride is CCCC(C)CC(=O)NC(C)(CN)C1CC1.Cl.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride?
The InChIKey is HZBJPCDBCXCHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-4-5-10(2)8-12(16)15-13(3,9-14)11-6-7-11;/h10-11H,4-9,14H2,1-3H3,(H,15,16);1H.
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride?
N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-3-methylhexanamide;hydrochloride is sourced from PubChem (CID 119574117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).