6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide

C19H23N5O2 — CID 122298313

IUPAC6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide
SMILESO=C(Nc1cnc(N2CCCC2)nc1)c1ccc(OC2CCCC2)nc1
InChIInChI=1S/C19H23N5O2/c25-18(14-7-8-17(20-11-14)26-16-5-1-2-6-16)23-15-12-21-19(22-13-15)24-9-3-4-10-24/h7-8,11-13,16H,1-6,9-10H2,(H,23,25)
InChIKeyKYBUYMRARQUXDU-UHFFFAOYSA-N
MW353.43 g/mol
LogP3.05
Rot. Bonds5

About 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide

6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide (PubChem CID 122298313) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide
PubChem CID122298313
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide
SMILESO=C(Nc1cnc(N2CCCC2)nc1)c1ccc(OC2CCCC2)nc1
InChIInChI=1S/C19H23N5O2/c25-18(14-7-8-17(20-11-14)26-16-5-1-2-6-16)23-15-12-21-19(22-13-15)24-9-3-4-10-24/h7-8,11-13,16H,1-6,9-10H2,(H,23,25)
InChIKeyKYBUYMRARQUXDU-UHFFFAOYSA-N
XLogP3.05
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-cyclopentyloxy-N-(2-morpholin-4-ylpyrimidin-5-yl)pyridine-3-carboxamide
CID 122298955
6-cyclopentyloxy-N-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide
CID 122356691
6-cyclopentyloxy-N-[2-(dimethylamino)pyrimidin-5-yl]pyridine-3-carboxamide
CID 122298052
N-[2-(azepan-1-yl)pyrimidin-5-yl]-6-chloropyridine-3-carboxamide
CID 53164742
4-methyl-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)benzamide
CID 53014756
N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-4-carboxamide
CID 71789978
N-(4-acetylphenyl)-2-(azepan-1-yl)pyrimidine-5-carboxamide
CID 109265010
6-cyclopentyloxy-N-[(4-piperidin-1-ylpyrimidin-2-yl)methyl]pyridine-3-carboxamide
CID 122318605
3,4-difluoro-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)benzamide
CID 53164633
4-phenoxy-N-(2-piperidin-1-ylpyrimidin-5-yl)benzamide
CID 122298612
1-[(6-cyclopentyloxypyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120515066
N-(2-piperidin-1-ylpyrimidin-5-yl)-4-(trifluoromethoxy)benzamide
CID 122298622

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide?
The IUPAC name of 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide (CID 122298313) is 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide is O=C(Nc1cnc(N2CCCC2)nc1)c1ccc(OC2CCCC2)nc1.
What is the InChIKey of 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide?
The InChIKey is KYBUYMRARQUXDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c25-18(14-7-8-17(20-11-14)26-16-5-1-2-6-16)23-15-12-21-19(22-13-15)24-9-3-4-10-24/h7-8,11-13,16H,1-6,9-10H2,(H,23,25).
What are the key properties of 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide?
6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide has a molecular weight of 353.43 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyloxy-N-(2-pyrrolidin-1-ylpyrimidin-5-yl)pyridine-3-carboxamide is sourced from PubChem (CID 122298313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).