N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide

C11H17N3O2 — CID 84575194

IUPACN-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide
SMILESCC(C)Nc1cc(C(=O)NCCO)ccn1
InChIInChI=1S/C11H17N3O2/c1-8(2)14-10-7-9(3-4-12-10)11(16)13-5-6-15/h3-4,7-8,15H,5-6H2,1-2H3,(H,12,14)(H,13,16)
InChIKeyKPJPCGSTFSXFPP-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.62
Rot. Bonds5

About N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide

N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide (PubChem CID 84575194) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide
PubChem CID84575194
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide
SMILESCC(C)Nc1cc(C(=O)NCCO)ccn1
InChIInChI=1S/C11H17N3O2/c1-8(2)14-10-7-9(3-4-12-10)11(16)13-5-6-15/h3-4,7-8,15H,5-6H2,1-2H3,(H,12,14)(H,13,16)
InChIKeyKPJPCGSTFSXFPP-UHFFFAOYSA-N
XLogP0.62
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(butan-2-ylamino)-N-butylpyridine-4-carboxamide
CID 109165401
N-benzhydryl-2-(propan-2-ylamino)pyridine-4-carboxamide
CID 84574553
2-(methylamino)-N-(4-propan-2-yloxybutyl)pyridine-4-carboxamide
CID 106015146
2-hydrazinyl-N-(5-methylhexyl)pyridine-4-carboxamide
CID 115327351
N-[2-(carbamoylamino)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 83115078
2-hydrazinyl-N-(7-methyloctyl)pyridine-4-carboxamide
CID 107818117
2-(2-hydroxyethylamino)pyridine-4-carboxylic acid
CID 53408816
N-(4-propan-2-yloxybutyl)-2-(propylamino)pyridine-4-carboxamide
CID 106015134
2-(methylamino)-N-[3-(methylamino)-3-oxopropyl]pyridine-4-carboxamide
CID 62175030
N-butyl-2-(propylamino)pyridine-4-carboxamide
CID 62185279
2-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-4-carboxamide
CID 109167778
N-[2-[methyl(propan-2-yl)amino]ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62640587

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide (CID 84575194) is N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide is CC(C)Nc1cc(C(=O)NCCO)ccn1.
What is the InChIKey of N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide?
The InChIKey is KPJPCGSTFSXFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8(2)14-10-7-9(3-4-12-10)11(16)13-5-6-15/h3-4,7-8,15H,5-6H2,1-2H3,(H,12,14)(H,13,16).
What are the key properties of N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide?
N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.62, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(propan-2-ylamino)pyridine-4-carboxamide is sourced from PubChem (CID 84575194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).