N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride

C14H22Cl2N2O — CID 119667896

IUPACN-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)Cc1ccccc1Cl.Cl
InChIInChI=1S/C14H21ClN2O.ClH/c1-2-3-7-12(10-16)17-14(18)9-11-6-4-5-8-13(11)15;/h4-6,8,12H,2-3,7,9-10,16H2,1H3,(H,17,18);1H
InChIKeyXIATYGDKUUJYOI-UHFFFAOYSA-N
MW305.25 g/mol
LogP2.94
Rot. Bonds7

About N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride

N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride (PubChem CID 119667896) has the molecular formula C14H22Cl2N2O and a molecular weight of 305.25 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride
PubChem CID119667896
Molecular FormulaC14H22Cl2N2O
Molecular Weight305.25 g/mol
Exact Mass304.11
IUPAC NameN-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)Cc1ccccc1Cl.Cl
InChIInChI=1S/C14H21ClN2O.ClH/c1-2-3-7-12(10-16)17-14(18)9-11-6-4-5-8-13(11)15;/h4-6,8,12H,2-3,7,9-10,16H2,1H3,(H,17,18);1H
InChIKeyXIATYGDKUUJYOI-UHFFFAOYSA-N
XLogP2.94
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.25
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 80697183
N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride
CID 119666599
N-(1-aminohexan-2-yl)-4-(2-chlorophenoxy)butanamide;hydrochloride
CID 119668746
2-(2-chlorophenyl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 103920161
N-(1-aminohexan-2-yl)-1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazole-4-carboxamide;hydrochloride
CID 119665355
N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride
CID 119664823
N-(1-aminopentan-2-yl)-2-phenylacetamide
CID 65191478
N-(1-aminohexan-2-yl)-3-chlorobenzamide;hydrochloride
CID 119667644
N-(1-aminohexan-2-yl)-3-phenylpentanamide;hydrochloride
CID 119668250
N-(1-aminohexan-2-yl)-2-(4-propan-2-ylphenoxy)acetamide;hydrochloride
CID 119667507
N-(1-aminohexan-2-yl)-2-(2,4-dichlorophenoxy)acetamide;hydrochloride
CID 119664799
N-(1-aminohexan-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetamide;hydrochloride
CID 119666826

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride (CID 119667896) is N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride is CCCCC(CN)NC(=O)Cc1ccccc1Cl.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride?
The InChIKey is XIATYGDKUUJYOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O.ClH/c1-2-3-7-12(10-16)17-14(18)9-11-6-4-5-8-13(11)15;/h4-6,8,12H,2-3,7,9-10,16H2,1H3,(H,17,18);1H.
What are the key properties of N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride?
N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride has a molecular weight of 305.25 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride is sourced from PubChem (CID 119667896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).