5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide

C9H13N3O2 — CID 150999370

IUPAC5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CNCCO)cn1
InChIInChI=1S/C9H13N3O2/c10-9(14)8-2-1-7(6-12-8)5-11-3-4-13/h1-2,6,11,13H,3-5H2,(H2,10,14)
InChIKeyLTTYTYBRYDDRAZ-UHFFFAOYSA-N
MW195.22 g/mol
LogP-0.74
Rot. Bonds5

About 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide

5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide (PubChem CID 150999370) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide
PubChem CID150999370
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CNCCO)cn1
InChIInChI=1S/C9H13N3O2/c10-9(14)8-2-1-7(6-12-8)5-11-3-4-13/h1-2,6,11,13H,3-5H2,(H2,10,14)
InChIKeyLTTYTYBRYDDRAZ-UHFFFAOYSA-N
XLogP-0.74
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-0.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

ethane;methyl 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxylate
CID 142388735
5-[(propan-2-ylamino)methyl]pyridine-2-carboxamide
CID 115906161
1-[5-[(2-aminoethylamino)methyl]-2-pyridinyl]ethanone
CID 70457829
5-[(cyclopentylamino)methyl]pyridine-2-carboxamide
CID 115685055
5-[(2-hydroxyethylamino)methyl]-N-[3-[3-[[5-[(2-hydroxyethylamino)methyl]pyridine-2-carbonyl]amino]-2-methylphenyl]-2-methylphenyl]pyridine-2-carboxamide;hydrochloride
CID 139537263
molecular hydrogen;5-[[[(2R)-oxolan-2-yl]methylamino]methyl]pyridine-2-carboxamide
CID 171489904
1-[5-[[5-(dimethylamino)pentylamino]methyl]-2-pyridinyl]ethanone
CID 145488759
5-[[bis(dimethylamino)methylideneamino]methyl]pyridine-2-carboxamide
CID 119152311
5-[4-[(2-cyclopentylethylamino)methyl]phenoxy]pyridine-2-carboxamide;methanesulfonic acid
CID 87560491
5-[2-methyl-4-[(octylamino)methyl]phenoxy]pyridine-2-carboxamide
CID 142876363
5-[2-fluoro-4-[(4-methylpentylamino)methyl]phenoxy]pyridine-2-carboxamide
CID 59730177
5-(pyridin-4-ylmethylcarbamoylamino)pyridine-2-carboxamide
CID 135223514

Frequently Asked Questions

What is the IUPAC name of 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide?
The IUPAC name of 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide (CID 150999370) is 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide is NC(=O)c1ccc(CNCCO)cn1.
What is the InChIKey of 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide?
The InChIKey is LTTYTYBRYDDRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c10-9(14)8-2-1-7(6-12-8)5-11-3-4-13/h1-2,6,11,13H,3-5H2,(H2,10,14).
What are the key properties of 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide?
5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide has a molecular weight of 195.22 g/mol, XLogP of -0.74, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 150999370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).