6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide

C10H16N4O2 — CID 64541071

IUPAC6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide
SMILESCC(O)C(N)CNc1ccc(C(N)=O)cn1
InChIInChI=1S/C10H16N4O2/c1-6(15)8(11)5-14-9-3-2-7(4-13-9)10(12)16/h2-4,6,8,15H,5,11H2,1H3,(H2,12,16)(H,13,14)
InChIKeyLBEAAHLCXFZLKH-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.70
Rot. Bonds5

About 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide

6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide (PubChem CID 64541071) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide
PubChem CID64541071
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide
SMILESCC(O)C(N)CNc1ccc(C(N)=O)cn1
InChIInChI=1S/C10H16N4O2/c1-6(15)8(11)5-14-9-3-2-7(4-13-9)10(12)16/h2-4,6,8,15H,5,11H2,1H3,(H2,12,16)(H,13,14)
InChIKeyLBEAAHLCXFZLKH-UHFFFAOYSA-N
XLogP-0.70
TPSA114.26 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.70
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-methoxypropylamino)pyridine-3-carboxamide
CID 102699145
2-[(2-amino-3-hydroxybutyl)amino]pyridine-4-carboxamide
CID 64539180
4-[(2-amino-3-hydroxybutyl)amino]benzamide
CID 64541293
6-[2-(propan-2-ylamino)ethylamino]pyridine-3-carboxamide
CID 62663227
6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carbonitrile
CID 64541282
6-(5-methylhexylamino)pyridine-3-carboxamide
CID 79003295
6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridine-3-carboxamide
CID 79830819
6-(4-hydroxybutylamino)pyridine-3-carboxamide
CID 106842705
6-(1-aminopropan-2-ylamino)pyridine-3-carboxamide
CID 63732982
6-(4-hydroxybutan-2-ylamino)pyridine-3-carboxamide
CID 79003427
6-(hexylamino)pyridine-3-carboxamide
CID 112722796
6-[(4-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 112722784

Frequently Asked Questions

What is the IUPAC name of 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide?
The IUPAC name of 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide (CID 64541071) is 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide is CC(O)C(N)CNc1ccc(C(N)=O)cn1.
What is the InChIKey of 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide?
The InChIKey is LBEAAHLCXFZLKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-6(15)8(11)5-14-9-3-2-7(4-13-9)10(12)16/h2-4,6,8,15H,5,11H2,1H3,(H2,12,16)(H,13,14).
What are the key properties of 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide?
6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of -0.70, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-amino-3-hydroxybutyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 64541071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).