N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide

C16H18N2O3 — CID 63860432

IUPACN-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide
SMILESO=C(c1cncc(O)c1)N(Cc1ccco1)C1CCCC1
InChIInChI=1S/C16H18N2O3/c19-14-8-12(9-17-10-14)16(20)18(13-4-1-2-5-13)11-15-6-3-7-21-15/h3,6-10,13,19H,1-2,4-5,11H2
InChIKeyOLJJOSDUJSAAQW-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.97
Rot. Bonds4

About N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide

N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide (PubChem CID 63860432) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide
PubChem CID63860432
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide
SMILESO=C(c1cncc(O)c1)N(Cc1ccco1)C1CCCC1
InChIInChI=1S/C16H18N2O3/c19-14-8-12(9-17-10-14)16(20)18(13-4-1-2-5-13)11-15-6-3-7-21-15/h3,6-10,13,19H,1-2,4-5,11H2
InChIKeyOLJJOSDUJSAAQW-UHFFFAOYSA-N
XLogP2.97
TPSA66.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide (CID 63860432) is N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide is O=C(c1cncc(O)c1)N(Cc1ccco1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide?
The InChIKey is OLJJOSDUJSAAQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-14-8-12(9-17-10-14)16(20)18(13-4-1-2-5-13)11-15-6-3-7-21-15/h3,6-10,13,19H,1-2,4-5,11H2.
What are the key properties of N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide?
N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63860432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).