5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one

C19H29N5O — CID 143885421

IUPAC5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one
SMILESCCCCC(C)Nc1ncc2c(N)cc(=O)n(C3CCCCC3)c2n1
InChIInChI=1S/C19H29N5O/c1-3-4-8-13(2)22-19-21-12-15-16(20)11-17(25)24(18(15)23-19)14-9-6-5-7-10-14/h11-14H,3-10,20H2,1-2H3,(H,21,22,23)
InChIKeyRXMWGCHERKTKRN-UHFFFAOYSA-N
MW343.48 g/mol
LogP3.87
Rot. Bonds6

About 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one

5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one (PubChem CID 143885421) has the molecular formula C19H29N5O and a molecular weight of 343.48 g/mol. Its IUPAC name is 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one
PubChem CID143885421
Molecular FormulaC19H29N5O
Molecular Weight343.48 g/mol
Exact Mass343.24
IUPAC Name5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one
SMILESCCCCC(C)Nc1ncc2c(N)cc(=O)n(C3CCCCC3)c2n1
InChIInChI=1S/C19H29N5O/c1-3-4-8-13(2)22-19-21-12-15-16(20)11-17(25)24(18(15)23-19)14-9-6-5-7-10-14/h11-14H,3-10,20H2,1-2H3,(H,21,22,23)
InChIKeyRXMWGCHERKTKRN-UHFFFAOYSA-N
XLogP3.87
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.48
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)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

acetamide;5-amino-8-cyclohexyl-2-(cyclohexylamino)pyrido[2,3-d]pyrimidin-7-one
CID 143885415
5-amino-2-(butan-2-ylamino)-8-cyclobutyl-6-methylpyrido[2,3-d]pyrimidin-7-one
CID 143885408
5-amino-8-cyclohexyl-2-[(6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]pyrido[2,3-d]pyrimidin-7-one
CID 177309638
3-(butylamino)-8-chloro-5-cyclohexylpyrimido[4,5-c]isoquinolin-6-one
CID 145439602
8-cyclopentyl-5-methyl-2-methylsulfinylpyrido[2,3-d]pyrimidin-7-one
CID 11483180
8-cyclopentyl-2-[4-(3,5-dimethylpiperazin-1-yl)anilino]-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-7-one
CID 139969358
8-cyclopentyl-2-[4-(diethylphosphoryloxymethyl)anilino]-5-methylpyrido[2,3-d]pyrimidin-7-one
CID 175240498
8-cyclopentyl-7-oxo-2-(propan-2-ylamino)pyrido[2,3-d]pyrimidine-6-carbonitrile
CID 155458571
4-[5-(5-azatricyclo[4.2.0.01,4]oct-2-en-2-yl)-2-(hexan-2-ylamino)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexan-1-ol
CID 123879081
8-cyclopentyl-2-[4-(3-hydroxypyrrolidin-1-yl)anilino]-5-methylpyrido[2,3-d]pyrimidin-7-one
CID 5330345
4-[3-[1-(cyclohexylmethyl)piperidin-4-yl]-6-[[(2S)-pentan-2-yl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]cyclohexan-1-ol
CID 153365717
tert-butyl 4-[4-[(8-cyclopentyl-5-ethyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperazine-1-carboxylate
CID 11752697

Frequently Asked Questions

What is the IUPAC name of 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one (CID 143885421) is 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one is CCCCC(C)Nc1ncc2c(N)cc(=O)n(C3CCCCC3)c2n1.
What is the InChIKey of 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is RXMWGCHERKTKRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O/c1-3-4-8-13(2)22-19-21-12-15-16(20)11-17(25)24(18(15)23-19)14-9-6-5-7-10-14/h11-14H,3-10,20H2,1-2H3,(H,21,22,23).
What are the key properties of 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one?
5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 343.48 g/mol, XLogP of 3.87, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-8-cyclohexyl-2-(hexan-2-ylamino)pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 143885421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).