(1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol

C14H18N4O — CID 97326266

IUPAC(1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol
SMILESO[C@H](CNc1ncnc2ncccc12)C1CCCC1
InChIInChI=1S/C14H18N4O/c19-12(10-4-1-2-5-10)8-16-14-11-6-3-7-15-13(11)17-9-18-14/h3,6-7,9-10,12,19H,1-2,4-5,8H2,(H,15,16,17,18)/t12-/m1/s1
InChIKeyRHKJOLBOQKUCKV-GFCCVEGCSA-N
MW258.32 g/mol
LogP1.99
Rot. Bonds4

About (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol

(1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol (PubChem CID 97326266) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol.

Molecular Properties

Compound Name(1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol
PubChem CID97326266
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name(1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol
SMILESO[C@H](CNc1ncnc2ncccc12)C1CCCC1
InChIInChI=1S/C14H18N4O/c19-12(10-4-1-2-5-10)8-16-14-11-6-3-7-15-13(11)17-9-18-14/h3,6-7,9-10,12,19H,1-2,4-5,8H2,(H,15,16,17,18)/t12-/m1/s1
InChIKeyRHKJOLBOQKUCKV-GFCCVEGCSA-N
XLogP1.99
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol 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

Slv320
CID 9953065
Trans-4-{[2-(Butylamino)-5-(Pyridin-2-Yl)pyrimidin-4-Yl]amino}cyclohexanol
CID 71819732
4-[[2-(Butylamino)-5-[5-[(2-hydroxyethylamino)methyl]-2-pyridinyl]pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 72792909
N-(oxolan-2-ylmethyl)-2-pyridin-3-ylquinazolin-4-amine
CID 4884951
2-[(2-Pyridin-3-ylquinazolin-4-yl)amino]ethanol
CID 1563686
trans-4-((2-(Methylamino)-5-(pyridin-2-yl)pyrimidin-4-yl)amino)cyclohexanol
CID 72793046
4-[[2-(Ethylamino)-5-pyridin-2-ylpyrimidin-4-yl]amino]cyclohexan-1-ol
CID 72793047
4-[[2-(Propylamino)-5-pyridin-2-ylpyrimidin-4-yl]amino]cyclohexan-1-ol
CID 72793048
4-[[2-(Pentylamino)-5-pyridin-2-ylpyrimidin-4-yl]amino]cyclohexan-1-ol
CID 72793105
4-[[2-(Pentan-2-ylamino)-5-pyridin-2-ylpyrimidin-4-yl]amino]cyclohexan-1-ol
CID 72793106
4-[[2-(Benzylamino)-5-pyridin-2-ylpyrimidin-4-yl]amino]cyclohexan-1-ol
CID 72793110
4-[[2-(2-Phenylethylamino)-5-pyridin-2-ylpyrimidin-4-yl]amino]cyclohexan-1-ol
CID 72793111

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol?
The IUPAC name of (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol (CID 97326266) is (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol.
What is the SMILES notation for (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol?
The canonical SMILES for (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol is O[C@H](CNc1ncnc2ncccc12)C1CCCC1.
What is the InChIKey of (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol?
The InChIKey is RHKJOLBOQKUCKV-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H18N4O/c19-12(10-4-1-2-5-10)8-16-14-11-6-3-7-15-13(11)17-9-18-14/h3,6-7,9-10,12,19H,1-2,4-5,8H2,(H,15,16,17,18)/t12-/m1/s1.
What are the key properties of (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol?
(1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol has a molecular weight of 258.32 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclopentyl-2-(pyrido[2,3-d]pyrimidin-4-ylamino)ethanol is sourced from PubChem (CID 97326266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).