2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol

C17H20ClN5O — CID 144532731

IUPAC2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol
SMILESNc1ccnc(-c2cnn3ccc(Cl)cc23)n1.OC1CCCCC1
InChIInChI=1S/C11H8ClN5.C6H12O/c12-7-2-4-17-9(5-7)8(6-15-17)11-14-3-1-10(13)16-11;7-6-4-2-1-3-5-6/h1-6H,(H2,13,14,16);6-7H,1-5H2
InChIKeyPXVUMKLMJHUUEE-UHFFFAOYSA-N
MW345.83 g/mol
LogP3.34
Rot. Bonds1

About 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol

2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol (PubChem CID 144532731) has the molecular formula C17H20ClN5O and a molecular weight of 345.83 g/mol. Its IUPAC name is 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol.

Molecular Properties

Compound Name2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol
PubChem CID144532731
Molecular FormulaC17H20ClN5O
Molecular Weight345.83 g/mol
Exact Mass345.14
IUPAC Name2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol
SMILESNc1ccnc(-c2cnn3ccc(Cl)cc23)n1.OC1CCCCC1
InChIInChI=1S/C11H8ClN5.C6H12O/c12-7-2-4-17-9(5-7)8(6-15-17)11-14-3-1-10(13)16-11;7-6-4-2-1-3-5-6/h1-6H,(H2,13,14,16);6-7H,1-5H2
InChIKeyPXVUMKLMJHUUEE-UHFFFAOYSA-N
XLogP3.34
TPSA89.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.83
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine
CID 144532732
2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)-9-[(4R)-4-hydroxy-3-oxocyclohexyl]-7H-purin-8-one
CID 144532715
1-[2-(5-chloro-2-methoxyphenyl)pyrimidin-4-yl]piperidin-4-ol
CID 74251022
3-[9-[(1R,3R)-3-hydroxycyclohexyl]-8-oxo-7H-purin-2-yl]pyrazolo[1,5-a]pyridine-5-carbonitrile
CID 67123912
5-(5-chloropyrazolo[1,5-a]pyridin-3-yl)-N-[(1R,2R)-1-[4-(cyclopropylsulfonylamino)-2-pyridinyl]-2-methyl-3-piperidin-1-ylpropyl]-1,3-thiazole-2-carboxamide
CID 169251456
4-[[3-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol
CID 66598126
5-(5-chloropyrazolo[1,5-a]pyridin-3-yl)-N-[(1R)-1-[4-(cyclopropylsulfonylamino)-2-pyridinyl]-2-hydroxy-2-methylpropyl]-1,3-thiazole-2-carboxamide
CID 169251107
2-(5-chloro-2-propan-2-yloxyphenyl)pyrimidin-4-amine;hydrochloride
CID 154906050
4-(5-chloropyrazolo[1,5-a]pyridin-3-yl)-N-[[4-(cyclopropylsulfanylamino)-2-pyridinyl]methyl]-2-fluorobenzamide
CID 169251760
5-(5-chloropyrazolo[1,5-a]pyridin-3-yl)-N-[[4-(cyclopropylsulfanylamino)-3-fluoro-2-pyridinyl]-[(3S)-oxolan-3-yl]methyl]-1,3-thiazole-2-carboxamide
CID 169251133
cyclohexanol;4-[1-methyl-5-(prop-1-en-2-ylamino)pyrazol-4-yl]pyrimidin-2-amine
CID 143575181
3-(4-aminopyrimidin-2-yl)cyclohexan-1-ol
CID 166653637

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol?
The IUPAC name of 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol (CID 144532731) is 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol.
What is the SMILES notation for 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol?
The canonical SMILES for 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol is Nc1ccnc(-c2cnn3ccc(Cl)cc23)n1.OC1CCCCC1.
What is the InChIKey of 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol?
The InChIKey is PXVUMKLMJHUUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClN5.C6H12O/c12-7-2-4-17-9(5-7)8(6-15-17)11-14-3-1-10(13)16-11;7-6-4-2-1-3-5-6/h1-6H,(H2,13,14,16);6-7H,1-5H2.
What are the key properties of 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol?
2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol has a molecular weight of 345.83 g/mol, XLogP of 3.34, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloropyrazolo[1,5-a]pyridin-3-yl)pyrimidin-4-amine;cyclohexanol is sourced from PubChem (CID 144532731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).