N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide

C25H26N2O3 — CID 91815243

IUPACN-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
SMILESO=C(NCCC(c1ccccc1)c1ccccc1)c1ccnc(OC2CCOC2)c1
InChIInChI=1S/C25H26N2O3/c28-25(21-11-14-26-24(17-21)30-22-13-16-29-18-22)27-15-12-23(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-11,14,17,22-23H,12-13,15-16,18H2,(H,27,28)
InChIKeyFEQUZEIAJWWVBI-UHFFFAOYSA-N
MW402.49 g/mol
LogP4.20
Rot. Bonds8

About N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide

N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide (PubChem CID 91815243) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
PubChem CID91815243
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC NameN-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
SMILESO=C(NCCC(c1ccccc1)c1ccccc1)c1ccnc(OC2CCOC2)c1
InChIInChI=1S/C25H26N2O3/c28-25(21-11-14-26-24(17-21)30-22-13-16-29-18-22)27-15-12-23(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-11,14,17,22-23H,12-13,15-16,18H2,(H,27,28)
InChIKeyFEQUZEIAJWWVBI-UHFFFAOYSA-N
XLogP4.20
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,3-diphenylpropyl)-6-[(3R)-oxolan-3-yl]oxypyridine-3-carboxamide
CID 100730209
N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 75504581
N-[3-(dimethylamino)propyl]-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide
CID 124617634
N-[3-(dimethylamino)propyl]-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815235
N-cyclododecyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 121160706
N-cyclohexyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815236
N-[2-(2-methylindol-1-yl)ethyl]-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815307
N-(2,3-dihydro-1H-inden-2-yl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 166214316
2-(oxolan-3-yloxy)pyridine-4-carboxylic acid
CID 63559237
(2S)-2-[[2-(oxolan-3-yloxy)pyridine-4-carbonyl]amino]propanoic acid
CID 120525990
(2S)-4-methyl-2-[[2-[[2-(oxolan-3-yloxy)pyridine-4-carbonyl]amino]acetyl]amino]pentanoic acid
CID 120695356
N-(2,6-difluorophenyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815300

Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
The IUPAC name of N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide (CID 91815243) is N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide is O=C(NCCC(c1ccccc1)c1ccccc1)c1ccnc(OC2CCOC2)c1.
What is the InChIKey of N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
The InChIKey is FEQUZEIAJWWVBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c28-25(21-11-14-26-24(17-21)30-22-13-16-29-18-22)27-15-12-23(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-11,14,17,22-23H,12-13,15-16,18H2,(H,27,28).
What are the key properties of N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide?
N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide has a molecular weight of 402.49 g/mol, XLogP of 4.20, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide is sourced from PubChem (CID 91815243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).