4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide

C11H16ClN3O — CID 83167037

IUPAC4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide
SMILESCC(C)(N)CCC(=O)Nc1cnccc1Cl
InChIInChI=1S/C11H16ClN3O/c1-11(2,13)5-3-10(16)15-9-7-14-6-4-8(9)12/h4,6-7H,3,5,13H2,1-2H3,(H,15,16)
InChIKeySAGLGLYRJJXHAZ-UHFFFAOYSA-N
MW241.72 g/mol
LogP2.19
Rot. Bonds4

About 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide

4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide (PubChem CID 83167037) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide.

Molecular Properties

Compound Name4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide
PubChem CID83167037
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide
SMILESCC(C)(N)CCC(=O)Nc1cnccc1Cl
InChIInChI=1S/C11H16ClN3O/c1-11(2,13)5-3-10(16)15-9-7-14-6-4-8(9)12/h4,6-7H,3,5,13H2,1-2H3,(H,15,16)
InChIKeySAGLGLYRJJXHAZ-UHFFFAOYSA-N
XLogP2.19
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-chloro-3-pyridinyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 83165894
N-(4-chloro-3-pyridinyl)-5-hydroxypentanamide
CID 83166682
4-amino-N-(2,5-dichloro-4-methylphenyl)-4-methylpentanamide
CID 104727177
(4-chloro-3-pyridinyl)carbamic acid
CID 54010428
2-(azetidin-3-yl)-N-(4-chloro-3-pyridinyl)acetamide
CID 83167857
4-amino-N-(2-chloro-4-methyl-3-pyridinyl)-4-methylpentanamide
CID 65491474
2-(3-aminophenyl)-N-(4-chloro-3-pyridinyl)acetamide
CID 83164175
N-(4-chloro-3-pyridinyl)-2,6-dimethylbenzamide
CID 103769247
N-(4-chloro-3-pyridinyl)-2-phenylsulfanylacetamide
CID 113238219
N-(4-chloro-3-pyridinyl)prop-2-enamide
CID 83167019
1-N-(3-chloro-4-pyridinyl)-2-methylpropane-1,2-diamine
CID 115303812
N-(4-chloro-3-pyridinyl)-3-(oxan-2-yl)propanamide
CID 103745081

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide?
The IUPAC name of 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide (CID 83167037) is 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide.
What is the SMILES notation for 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide?
The canonical SMILES for 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide is CC(C)(N)CCC(=O)Nc1cnccc1Cl.
What is the InChIKey of 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide?
The InChIKey is SAGLGLYRJJXHAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-11(2,13)5-3-10(16)15-9-7-14-6-4-8(9)12/h4,6-7H,3,5,13H2,1-2H3,(H,15,16).
What are the key properties of 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide?
4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide has a molecular weight of 241.72 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-chloro-3-pyridinyl)-4-methylpentanamide is sourced from PubChem (CID 83167037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).