4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol

C19H26N6O — CID 69400165

IUPAC4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
SMILESCC(C)C1CC=Nc2c(-c3ccnc(NC4CCC(O)CC4)n3)cnn21
InChIInChI=1S/C19H26N6O/c1-12(2)17-8-10-20-18-15(11-22-25(17)18)16-7-9-21-19(24-16)23-13-3-5-14(26)6-4-13/h7,9-14,17,26H,3-6,8H2,1-2H3,(H,21,23,24)
InChIKeyPPAFCKICSSPQHL-UHFFFAOYSA-N
MW354.46 g/mol
LogP3.36
Rot. Bonds4

About 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol

4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol (PubChem CID 69400165) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
PubChem CID69400165
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC Name4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
SMILESCC(C)C1CC=Nc2c(-c3ccnc(NC4CCC(O)CC4)n3)cnn21
InChIInChI=1S/C19H26N6O/c1-12(2)17-8-10-20-18-15(11-22-25(17)18)16-7-9-21-19(24-16)23-13-3-5-14(26)6-4-13/h7,9-14,17,26H,3-6,8H2,1-2H3,(H,21,23,24)
InChIKeyPPAFCKICSSPQHL-UHFFFAOYSA-N
XLogP3.36
TPSA88.22 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol with MolForge

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Related Compounds

4-[[4-(1,5-dimethylpyrazol-4-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
CID 143574911
4-[[4-(1-methyl-5-piperazin-1-ylpyrazol-4-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
CID 143575101
4-N-[4-[5-(cyclopropylmethyl)-1-methylpyrazol-4-yl]pyrimidin-2-yl]-1-N-methylcyclohexane-1,4-diamine
CID 126558959
N-[4-(1-aminoethyl)cyclohexyl]-4-(5-amino-1-methylpyrazol-4-yl)pyrimidin-2-amine;3,4,5-trimethyl-2H-pyrrole
CID 143574935
4-N,4-N-dimethyl-1-N-[4-(2-methyl-3-propan-2-ylimidazol-4-yl)pyrimidin-2-yl]cyclohexane-1,4-diamine
CID 68557934
4-[[4-(1,2-benzoxazol-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
CID 24960636
1-[4-[[4-(5-amino-1-methylpyrazol-4-yl)pyrimidin-2-yl]amino]cyclohexyl]-3-phenylurea
CID 70313203
4-(5-amino-1-methylpyrazol-4-yl)-N-[1-(2-methylpropylsulfonyl)piperidin-4-yl]pyrimidin-2-amine
CID 70312473
N-cyclopropyl-4-(3-methylpyrazin-2-yl)pyrimidin-2-amine
CID 114080483
4-[[4-(2-methyl-3-propan-2-ylimidazol-4-yl)pyrimidin-2-yl]amino]cyclohexane-1-carboxylic acid
CID 68556119
N-cyclopentyl-4-(7-fluoro-2-methyl-3-propan-2-ylpyrazolo[4,3-b]pyridin-5-yl)pyrimidin-2-amine
CID 169234797
4-(1-aminoethyl)-N-cyclopropylpyrimidin-2-amine
CID 130595504

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol?
The IUPAC name of 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol (CID 69400165) is 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol?
The canonical SMILES for 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol is CC(C)C1CC=Nc2c(-c3ccnc(NC4CCC(O)CC4)n3)cnn21.
What is the InChIKey of 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol?
The InChIKey is PPAFCKICSSPQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O/c1-12(2)17-8-10-20-18-15(11-22-25(17)18)16-7-9-21-19(24-16)23-13-3-5-14(26)6-4-13/h7,9-14,17,26H,3-6,8H2,1-2H3,(H,21,23,24).
What are the key properties of 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol?
4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol has a molecular weight of 354.46 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(7-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrimidin-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol is sourced from PubChem (CID 69400165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).