8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one

C29H33N5O2 — CID 156767124

IUPAC8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one
SMILESO=c1cc(-c2ccoc2)c2cnc(N3CCC(NCCc4ccccc4)CC3)nc2n1C1CCCC1
InChIInChI=1S/C29H33N5O2/c35-27-18-25(22-13-17-36-20-22)26-19-31-29(32-28(26)34(27)24-8-4-5-9-24)33-15-11-23(12-16-33)30-14-10-21-6-2-1-3-7-21/h1-3,6-7,13,17-20,23-24,30H,4-5,8-12,14-16H2
InChIKeyTVEGFIKFINJJAU-UHFFFAOYSA-N
MW483.62 g/mol
LogP4.97
Rot. Bonds7

About 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one

8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one (PubChem CID 156767124) has the molecular formula C29H33N5O2 and a molecular weight of 483.62 g/mol. Its IUPAC name is 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one
PubChem CID156767124
Molecular FormulaC29H33N5O2
Molecular Weight483.62 g/mol
Exact Mass483.26
IUPAC Name8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one
SMILESO=c1cc(-c2ccoc2)c2cnc(N3CCC(NCCc4ccccc4)CC3)nc2n1C1CCCC1
InChIInChI=1S/C29H33N5O2/c35-27-18-25(22-13-17-36-20-22)26-19-31-29(32-28(26)34(27)24-8-4-5-9-24)33-15-11-23(12-16-33)30-14-10-21-6-2-1-3-7-21/h1-3,6-7,13,17-20,23-24,30H,4-5,8-12,14-16H2
InChIKeyTVEGFIKFINJJAU-UHFFFAOYSA-N
XLogP4.97
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.62
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-cyclopentyl-2-[4-(2-phenylethylamino)piperidin-1-yl]-5-[4-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-7-one
CID 156767137
8-cyclopentyl-5-(3-methoxyphenyl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one
CID 156767151
8-cyclopentyl-2-[4-(2-phenylethylamino)piperidin-1-yl]-6-[4-(trifluoromethyl)phenyl]pyrido[2,3-d]pyrimidin-7-one
CID 156769367
3-[8-cyclopentyl-7-oxo-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-6-yl]benzaldehyde
CID 156769359
tert-butyl N-[1-[8-cyclopentyl-7-oxo-5-(5-trimethylsilyl-2H-triazol-4-yl)pyrido[2,3-d]pyrimidin-2-yl]piperidin-4-yl]-N-(2-phenylethyl)carbamate
CID 166451378
(4R)-1-(4,7-dimethylquinazolin-2-yl)-N-(2-phenylethyl)azepan-4-amine
CID 26344248
5-[2-(3-chlorophenyl)ethynyl]-8-(2-methylpropyl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one
CID 166451347
8-cyclopentyl-2-(3,6-dihydro-2H-pyridin-1-yl)-5-methylpyrido[2,3-d]pyrimidin-7-one
CID 171328105
[2-tert-butyl-1-(8-cyclopentyl-5-ethynyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)piperidin-4-yl] N-(2-phenylethyl)carbamate
CID 163214365
N-(2-pyridin-3-ylethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 72912791
N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675384
8-cyclopentyl-2-[4-(2-methoxyethyl)piperazin-1-yl]-5-methylpyrido[2,3-d]pyrimidin-7-one
CID 171337934

Frequently Asked Questions

What is the IUPAC name of 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one (CID 156767124) is 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one is O=c1cc(-c2ccoc2)c2cnc(N3CCC(NCCc4ccccc4)CC3)nc2n1C1CCCC1.
What is the InChIKey of 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is TVEGFIKFINJJAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33N5O2/c35-27-18-25(22-13-17-36-20-22)26-19-31-29(32-28(26)34(27)24-8-4-5-9-24)33-15-11-23(12-16-33)30-14-10-21-6-2-1-3-7-21/h1-3,6-7,13,17-20,23-24,30H,4-5,8-12,14-16H2.
What are the key properties of 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one?
8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 483.62 g/mol, XLogP of 4.97, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopentyl-5-(furan-3-yl)-2-[4-(2-phenylethylamino)piperidin-1-yl]pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 156767124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).