5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide

C11H16ClN3O — CID 104683574

IUPAC5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide
SMILESCC(CCCN)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C11H16ClN3O/c1-8(3-2-6-13)11(16)15-10-5-4-9(12)7-14-10/h4-5,7-8H,2-3,6,13H2,1H3,(H,14,15,16)
InChIKeyTXBHQWRINPZERP-UHFFFAOYSA-N
MW241.72 g/mol
LogP2.05
Rot. Bonds5

About 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide

5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide (PubChem CID 104683574) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide
PubChem CID104683574
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide
SMILESCC(CCCN)C(=O)Nc1ccc(Cl)cn1
InChIInChI=1S/C11H16ClN3O/c1-8(3-2-6-13)11(16)15-10-5-4-9(12)7-14-10/h4-5,7-8H,2-3,6,13H2,1H3,(H,14,15,16)
InChIKeyTXBHQWRINPZERP-UHFFFAOYSA-N
XLogP2.05
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(5-chloro-2-pyridinyl)propanamide
CID 61146165
2-(aminomethyl)-N-(5-chloro-2-pyridinyl)-3-methylbutanamide
CID 65226103
5-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpentanamide
CID 104685319
2-amino-N-(5-chloro-2-pyridinyl)-3-methylbutanamide
CID 76892362
2-amino-N-(5-chloro-2-pyridinyl)butanamide
CID 60779855
3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide
CID 106111210
N-(5-chloro-2-pyridinyl)-2-methylsulfonylpropanamide
CID 55756646
5-amino-N-(2-bromo-4-chlorophenyl)-2-methylpentanamide
CID 113441065
(2S)-2-amino-N-(5-chloro-2-pyridinyl)-4-phenylbutanamide
CID 104983845
2-[(5-amino-2-methylpentanoyl)amino]-4-chloro-N,N-dimethylbenzamide
CID 104683758
4-[(5-amino-2-methylpentanoyl)amino]-2-chlorobenzamide
CID 104684164
4-[(5-amino-2-methylpentanoyl)amino]-2-chlorobenzoic acid
CID 112547679

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide?
The IUPAC name of 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide (CID 104683574) is 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide.
What is the SMILES notation for 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide?
The canonical SMILES for 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide is CC(CCCN)C(=O)Nc1ccc(Cl)cn1.
What is the InChIKey of 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide?
The InChIKey is TXBHQWRINPZERP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-8(3-2-6-13)11(16)15-10-5-4-9(12)7-14-10/h4-5,7-8H,2-3,6,13H2,1H3,(H,14,15,16).
What are the key properties of 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide?
5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide has a molecular weight of 241.72 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(5-chloro-2-pyridinyl)-2-methylpentanamide is sourced from PubChem (CID 104683574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).