N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide

C13H18N2O2 — CID 61443052

IUPACN-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide
SMILESCCCCN(C(=O)c1ncccc1O)C1CC1
InChIInChI=1S/C13H18N2O2/c1-2-3-9-15(10-6-7-10)13(17)12-11(16)5-4-8-14-12/h4-5,8,10,16H,2-3,6-7,9H2,1H3
InChIKeyGXJVHQTTZZHGRX-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.19
Rot. Bonds5

About N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide

N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide (PubChem CID 61443052) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide
PubChem CID61443052
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide
SMILESCCCCN(C(=O)c1ncccc1O)C1CC1
InChIInChI=1S/C13H18N2O2/c1-2-3-9-15(10-6-7-10)13(17)12-11(16)5-4-8-14-12/h4-5,8,10,16H,2-3,6-7,9H2,1H3
InChIKeyGXJVHQTTZZHGRX-UHFFFAOYSA-N
XLogP2.19
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide?
The IUPAC name of N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide (CID 61443052) is N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide is CCCCN(C(=O)c1ncccc1O)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide?
The InChIKey is GXJVHQTTZZHGRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-2-3-9-15(10-6-7-10)13(17)12-11(16)5-4-8-14-12/h4-5,8,10,16H,2-3,6-7,9H2,1H3.
What are the key properties of N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide?
N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 61443052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).