4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol

C19H22N4O2 — CID 59662580

IUPAC4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol
SMILESCOc1ccc(-c2cnn3ccc(NC4CCC(O)CC4)nc23)cc1
InChIInChI=1S/C19H22N4O2/c1-25-16-8-2-13(3-9-16)17-12-20-23-11-10-18(22-19(17)23)21-14-4-6-15(24)7-5-14/h2-3,8-12,14-15,24H,4-7H2,1H3,(H,21,22)
InChIKeyAFGYTSSJFPJGGX-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.12
Rot. Bonds4

About 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol

4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol (PubChem CID 59662580) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol
PubChem CID59662580
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol
SMILESCOc1ccc(-c2cnn3ccc(NC4CCC(O)CC4)nc23)cc1
InChIInChI=1S/C19H22N4O2/c1-25-16-8-2-13(3-9-16)17-12-20-23-11-10-18(22-19(17)23)21-14-4-6-15(24)7-5-14/h2-3,8-12,14-15,24H,4-7H2,1H3,(H,21,22)
InChIKeyAFGYTSSJFPJGGX-UHFFFAOYSA-N
XLogP3.12
TPSA71.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol with MolForge

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Related Compounds

3-(3,5-dimethoxyphenyl)-N-piperidin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 24865113
4-[[3-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol
CID 66598126
N-(4-methoxycyclohexyl)-3-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 66615220
3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine
CID 71150900
N-(4,4-difluorocyclohexyl)-5-[(4-hydroxycyclohexyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 58063436
4-[5-[(6-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]phenol
CID 24864574
3-(1-benzylpyrazol-4-yl)-N-cyclohexylpyrazolo[1,5-a]pyrimidin-5-amine
CID 143598135
N-(cyclopropylmethyl)-3-naphthalen-2-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 72545501
N-(1,1-dioxothian-4-yl)-3-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 118720919
N-(4-methoxyphenyl)-4-[5-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]benzamide;3-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 159643619
4-[5-(3,4-dimethoxy-5-methylanilino)pyrazolo[1,5-a]pyrimidin-3-yl]phenol
CID 71150937
3-(3,4-dimethoxyphenyl)-N-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 24864577

Frequently Asked Questions

What is the IUPAC name of 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol?
The IUPAC name of 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol (CID 59662580) is 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol?
The canonical SMILES for 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol is COc1ccc(-c2cnn3ccc(NC4CCC(O)CC4)nc23)cc1.
What is the InChIKey of 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol?
The InChIKey is AFGYTSSJFPJGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-25-16-8-2-13(3-9-16)17-12-20-23-11-10-18(22-19(17)23)21-14-4-6-15(24)7-5-14/h2-3,8-12,14-15,24H,4-7H2,1H3,(H,21,22).
What are the key properties of 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol?
4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol has a molecular weight of 338.41 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol is sourced from PubChem (CID 59662580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).