cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone

C20H27N5O — CID 72900199

IUPACcyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone
SMILESCc1cc(C)c2c(NC3CCN(C(=O)C4CCCC4)CC3)ncnc2n1
InChIInChI=1S/C20H27N5O/c1-13-11-14(2)23-18-17(13)19(22-12-21-18)24-16-7-9-25(10-8-16)20(26)15-5-3-4-6-15/h11-12,15-16H,3-10H2,1-2H3,(H,21,22,23,24)
InChIKeyKSOHHDQKGXAPDL-UHFFFAOYSA-N
MW353.47 g/mol
LogP3.23
Rot. Bonds3

About cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone

cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone (PubChem CID 72900199) has the molecular formula C20H27N5O and a molecular weight of 353.47 g/mol. Its IUPAC name is cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone
PubChem CID72900199
Molecular FormulaC20H27N5O
Molecular Weight353.47 g/mol
Exact Mass353.22
IUPAC Namecyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone
SMILESCc1cc(C)c2c(NC3CCN(C(=O)C4CCCC4)CC3)ncnc2n1
InChIInChI=1S/C20H27N5O/c1-13-11-14(2)23-18-17(13)19(22-12-21-18)24-16-7-9-25(10-8-16)20(26)15-5-3-4-6-15/h11-12,15-16H,3-10H2,1-2H3,(H,21,22,23,24)
InChIKeyKSOHHDQKGXAPDL-UHFFFAOYSA-N
XLogP3.23
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone with MolForge

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Related Compounds

5,7-dimethyl-N-[1-(oxan-4-yl)piperidin-4-yl]pyrido[2,3-d]pyrimidin-4-amine
CID 72892101
cyclohexyl-[4-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone
CID 133409423
cyclopropyl-[4-[(4,6-dimethylpyrimidin-2-yl)amino]piperidin-1-yl]methanone
CID 47156722
5,7-dimethyl-N-[[(2S)-1-methylpiperidin-2-yl]methyl]pyrido[2,3-d]pyrimidin-4-amine
CID 97190031
1-[4-[(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)amino]piperidin-1-yl]ethanone
CID 95813797
5,7-dimethyl-N-[(3R,4R)-4-piperidin-1-yloxolan-3-yl]pyrido[2,3-d]pyrimidin-4-amine
CID 72858601
5,7-dimethyl-N-[2-(1-methylsulfonylpiperidin-2-yl)ethyl]pyrido[2,3-d]pyrimidin-4-amine
CID 72840824
[3-[(3-bromo-1-methylpyrazolo[3,4-d]pyrimidin-4-yl)amino]pyrrolidin-1-yl]-cyclopentylmethanone
CID 133366822
[4-[(6-methylpyrimidin-4-yl)amino]piperidin-1-yl]-(oxan-4-yl)methanone
CID 126887514
ethyl 4-[[1-(cyclopentanecarbonyl)pyrrolidin-3-yl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate
CID 133386677
cyclohexyl-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 108755282
2-(cyclobutylamino)-4,6-dimethylpyridine-3-carboxylic acid
CID 62414994

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone (CID 72900199) is cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone is Cc1cc(C)c2c(NC3CCN(C(=O)C4CCCC4)CC3)ncnc2n1.
What is the InChIKey of cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone?
The InChIKey is KSOHHDQKGXAPDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N5O/c1-13-11-14(2)23-18-17(13)19(22-12-21-18)24-16-7-9-25(10-8-16)20(26)15-5-3-4-6-15/h11-12,15-16H,3-10H2,1-2H3,(H,21,22,23,24).
What are the key properties of cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone?
cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone has a molecular weight of 353.47 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]methanone is sourced from PubChem (CID 72900199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).