N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide

C9H11N3O3 — CID 54423977

IUPACN-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide
SMILESN[C@@H](CO)C(=O)NC(=O)c1ccccn1
InChIInChI=1S/C9H11N3O3/c10-6(5-13)8(14)12-9(15)7-3-1-2-4-11-7/h1-4,6,13H,5,10H2,(H,12,14,15)/t6-/m0/s1
InChIKeyWCTRYINYUCNTFL-LURJTMIESA-N
MW209.21 g/mol
LogP-1.34
Rot. Bonds3

About N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide

N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide (PubChem CID 54423977) has the molecular formula C9H11N3O3 and a molecular weight of 209.21 g/mol. Its IUPAC name is N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide
PubChem CID54423977
Molecular FormulaC9H11N3O3
Molecular Weight209.21 g/mol
Exact Mass209.08
IUPAC NameN-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide
SMILESN[C@@H](CO)C(=O)NC(=O)c1ccccn1
InChIInChI=1S/C9H11N3O3/c10-6(5-13)8(14)12-9(15)7-3-1-2-4-11-7/h1-4,6,13H,5,10H2,(H,12,14,15)/t6-/m0/s1
InChIKeyWCTRYINYUCNTFL-LURJTMIESA-N
XLogP-1.34
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 5-1.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S,3S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-methylpentanoyl]pyridine-2-carboxamide
CID 70364739
N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 43392707
2-(pyridine-2-carbonylamino)prop-2-enoic acid
CID 11095447
ethyl 3-hydroxy-2-(pyridine-2-carbonylamino)propanoate
CID 70817337
N-[(2S)-3-hydroxy-1-[4-[[(2S)-3-hydroxy-2-(pyridine-2-carbonylamino)propanoyl]amino]butylamino]-1-oxopropan-2-yl]pyridine-2-carboxamide
CID 18666428
N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide
CID 16773462
N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide
CID 55169382
N-(2-methylprop-2-enoyl)pyridine-2-carboxamide
CID 22568298
N-(2-amino-4-methylpentyl)pyridine-2-carboxamide
CID 107158631
N-[2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoyl]pyridine-2-carboxamide
CID 102129763
N-[2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide;ruthenium(2+);dichloride
CID 46845295
N-(4-hydroxy-3-methylsulfanylbutan-2-yl)pyridine-2-carboxamide
CID 103799099

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide?
The IUPAC name of N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide (CID 54423977) is N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide?
The canonical SMILES for N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide is N[C@@H](CO)C(=O)NC(=O)c1ccccn1.
What is the InChIKey of N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide?
The InChIKey is WCTRYINYUCNTFL-LURJTMIESA-N. The full InChI is InChI=1S/C9H11N3O3/c10-6(5-13)8(14)12-9(15)7-3-1-2-4-11-7/h1-4,6,13H,5,10H2,(H,12,14,15)/t6-/m0/s1.
What are the key properties of N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide?
N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide has a molecular weight of 209.21 g/mol, XLogP of -1.34, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-amino-3-hydroxypropanoyl]pyridine-2-carboxamide is sourced from PubChem (CID 54423977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).