5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine

C21H26N6 — CID 97190501

IUPAC5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1cc(C)c2c(NC[C@H](c3cccnc3)N3CCCCC3)ncnc2n1
InChIInChI=1S/C21H26N6/c1-15-11-16(2)26-21-19(15)20(24-14-25-21)23-13-18(17-7-6-8-22-12-17)27-9-4-3-5-10-27/h6-8,11-12,14,18H,3-5,9-10,13H2,1-2H3,(H,23,24,25,26)/t18-/m1/s1
InChIKeyZGNKKBWFSAHQON-GOSISDBHSA-N
MW362.48 g/mol
LogP3.68
Rot. Bonds5

About 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine

5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine (PubChem CID 97190501) has the molecular formula C21H26N6 and a molecular weight of 362.48 g/mol. Its IUPAC name is 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine
PubChem CID97190501
Molecular FormulaC21H26N6
Molecular Weight362.48 g/mol
Exact Mass362.22
IUPAC Name5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine
SMILESCc1cc(C)c2c(NC[C@H](c3cccnc3)N3CCCCC3)ncnc2n1
InChIInChI=1S/C21H26N6/c1-15-11-16(2)26-21-19(15)20(24-14-25-21)23-13-18(17-7-6-8-22-12-17)27-9-4-3-5-10-27/h6-8,11-12,14,18H,3-5,9-10,13H2,1-2H3,(H,23,24,25,26)/t18-/m1/s1
InChIKeyZGNKKBWFSAHQON-GOSISDBHSA-N
XLogP3.68
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

5,7-dimethyl-N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]pyrido[2,3-d]pyrimidin-4-amine
CID 97210458
(2R)-1-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]-3-piperidin-1-ylpropan-2-ol
CID 97205363
3,6-dimethyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
CID 72925899
N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 97208706
5-methyl-4-(2-methylpyrazol-3-yl)-N-[(2R)-2-pyridin-3-yl-2-pyrrolidin-1-ylethyl]pyrimidin-2-amine
CID 29153886
(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine
CID 30075732
4-cyclobutyl-6-methyl-N-(2-morpholin-4-yl-2-pyridin-3-ylethyl)pyrimidin-2-amine
CID 56875402
(2S)-1-(dimethylamino)-3-[(5,7-dimethylpyrido[2,3-d]pyrimidin-4-yl)amino]propan-2-ol
CID 97187638
6-methyl-N-(2-phenyl-2-pyrrolidin-1-ylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 110430906
2-pyridin-3-yl-2-pyrrolidin-1-ylethanethiol
CID 142393925
3-(2-chloro-1-pyrrolidin-1-ylethyl)pyridine
CID 82078027
5-methoxy-2-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 146042975

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine (CID 97190501) is 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine is Cc1cc(C)c2c(NC[C@H](c3cccnc3)N3CCCCC3)ncnc2n1.
What is the InChIKey of 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is ZGNKKBWFSAHQON-GOSISDBHSA-N. The full InChI is InChI=1S/C21H26N6/c1-15-11-16(2)26-21-19(15)20(24-14-25-21)23-13-18(17-7-6-8-22-12-17)27-9-4-3-5-10-27/h6-8,11-12,14,18H,3-5,9-10,13H2,1-2H3,(H,23,24,25,26)/t18-/m1/s1.
What are the key properties of 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine?
5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 362.48 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]pyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 97190501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).