N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride

C13H22ClN3O — CID 119516110

IUPACN-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride
SMILESCC(C)CC(C)CC(=O)Nc1ccc(N)nc1.Cl
InChIInChI=1S/C13H21N3O.ClH/c1-9(2)6-10(3)7-13(17)16-11-4-5-12(14)15-8-11;/h4-5,8-10H,6-7H2,1-3H3,(H2,14,15)(H,16,17);1H
InChIKeyVEHOAYWQTBPZCT-UHFFFAOYSA-N
MW271.79 g/mol
LogP3.10
Rot. Bonds5

About N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride

N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride (PubChem CID 119516110) has the molecular formula C13H22ClN3O and a molecular weight of 271.79 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride
PubChem CID119516110
Molecular FormulaC13H22ClN3O
Molecular Weight271.79 g/mol
Exact Mass271.15
IUPAC NameN-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride
SMILESCC(C)CC(C)CC(=O)Nc1ccc(N)nc1.Cl
InChIInChI=1S/C13H21N3O.ClH/c1-9(2)6-10(3)7-13(17)16-11-4-5-12(14)15-8-11;/h4-5,8-10H,6-7H2,1-3H3,(H2,14,15)(H,16,17);1H
InChIKeyVEHOAYWQTBPZCT-UHFFFAOYSA-N
XLogP3.10
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.79
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-3-pyridinyl)-3-ethylheptanamide
CID 119515581
N-(6-amino-3-pyridinyl)-3-ethoxypropanamide;hydrochloride
CID 119515208
N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 119516013
N-(6-amino-3-pyridinyl)-2-methylpentanamide
CID 62899385
4-amino-N-(6-ethoxy-3-pyridinyl)-3-methylbutanamide
CID 81080925
N-(6-amino-3-pyridinyl)-2-cyclopropylacetamide
CID 62901685
N-(6-amino-3-pyridinyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride
CID 119515101
N-(6-amino-3-pyridinyl)-2-cyclopentylacetamide;hydrochloride
CID 119260450
N-(6-amino-3-pyridinyl)-2-ethoxypropanamide
CID 119516288
4-amino-3-methyl-N-(6-methylsulfonyl-3-pyridinyl)butanamide
CID 81075258
N-(6-amino-3-pyridinyl)-3-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]propanamide;hydrochloride
CID 119516505
N-(6-amino-3-pyridinyl)-2-(2-hydroxyphenyl)acetamide
CID 80741200

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride?
The IUPAC name of N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride (CID 119516110) is N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride?
The canonical SMILES for N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride is CC(C)CC(C)CC(=O)Nc1ccc(N)nc1.Cl.
What is the InChIKey of N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride?
The InChIKey is VEHOAYWQTBPZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O.ClH/c1-9(2)6-10(3)7-13(17)16-11-4-5-12(14)15-8-11;/h4-5,8-10H,6-7H2,1-3H3,(H2,14,15)(H,16,17);1H.
What are the key properties of N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride?
N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride has a molecular weight of 271.79 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-3,5-dimethylhexanamide;hydrochloride is sourced from PubChem (CID 119516110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).