5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide

C13H21N3O — CID 81317024

IUPAC5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
SMILESCCC(CC)C(C)NC(=O)c1ccc(N)cn1
InChIInChI=1S/C13H21N3O/c1-4-10(5-2)9(3)16-13(17)12-7-6-11(14)8-15-12/h6-10H,4-5,14H2,1-3H3,(H,16,17)
InChIKeyGWABLRFRACLQRU-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.22
Rot. Bonds5

About 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide

5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide (PubChem CID 81317024) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
PubChem CID81317024
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
SMILESCCC(CC)C(C)NC(=O)c1ccc(N)cn1
InChIInChI=1S/C13H21N3O/c1-4-10(5-2)9(3)16-13(17)12-7-6-11(14)8-15-12/h6-10H,4-5,14H2,1-3H3,(H,16,17)
InChIKeyGWABLRFRACLQRU-UHFFFAOYSA-N
XLogP2.22
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide
CID 63837989
5-amino-N-(4-hydroxy-3-methylsulfanylbutan-2-yl)pyridine-2-carboxamide
CID 106152400
5-amino-N-(4-methylpentan-2-yl)pyridine-2-carboxamide
CID 81315869
4-amino-N-(3-ethylpentan-2-yl)benzamide
CID 55261321
5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
CID 81317136
1-(5-amino-2-pyridinyl)-2-ethylbutan-1-one
CID 116605325
5-amino-N-prop-2-ynylpyridine-2-carboxamide
CID 81316148
5-amino-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
CID 81316387
5-amino-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide
CID 81315746
2-N-(3-ethylpentan-2-yl)pyridine-2,5-diamine
CID 63842921
5-amino-N-butan-2-yl-N-methylpyridine-2-carboxamide
CID 81317064
5-amino-N-(2-methylbutan-2-yl)pyridine-2-carboxamide
CID 81319675

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide (CID 81317024) is 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide is CCC(CC)C(C)NC(=O)c1ccc(N)cn1.
What is the InChIKey of 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
The InChIKey is GWABLRFRACLQRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-4-10(5-2)9(3)16-13(17)12-7-6-11(14)8-15-12/h6-10H,4-5,14H2,1-3H3,(H,16,17).
What are the key properties of 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide?
5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 2.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(3-ethylpentan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 81317024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).