1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol

C11H17N5O — CID 114253550

IUPAC1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol
SMILESCc1cc(NCC(O)Cn2cccn2)nn1C
InChIInChI=1S/C11H17N5O/c1-9-6-11(14-15(9)2)12-7-10(17)8-16-5-3-4-13-16/h3-6,10,17H,7-8H2,1-2H3,(H,12,14)
InChIKeyOTMPGMZOOFWDIR-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.40
Rot. Bonds5

About 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol

1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol (PubChem CID 114253550) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol
PubChem CID114253550
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol
SMILESCc1cc(NCC(O)Cn2cccn2)nn1C
InChIInChI=1S/C11H17N5O/c1-9-6-11(14-15(9)2)12-7-10(17)8-16-5-3-4-13-16/h3-6,10,17H,7-8H2,1-2H3,(H,12,14)
InChIKeyOTMPGMZOOFWDIR-UHFFFAOYSA-N
XLogP0.40
TPSA67.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-[(1,5-dimethylpyrazol-4-yl)methylamino]-3-pyrazol-1-ylpropan-2-ol
CID 106044829
1-[3-(dimethylamino)-4-methylanilino]-3-pyrazol-1-ylpropan-2-ol
CID 115378206
1-(3,5-dichloroanilino)-3-pyrazol-1-ylpropan-2-ol
CID 60896952
1-(2-chloro-4-methylanilino)-3-pyrazol-1-ylpropan-2-ol
CID 60899821
1-[(1-methylpyrazol-3-yl)methylamino]-3-pyrazol-1-ylpropan-2-ol
CID 82881683
1-(3,4-dichloroanilino)-3-pyrazol-1-ylpropan-2-ol
CID 60897345
1-(3-bromo-2-methylanilino)-3-pyrazol-1-ylpropan-2-ol
CID 107633847
1-(2-methylpropylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60904302
(2R)-1-N-(1,5-dimethylpyrazol-3-yl)-3-methylbutane-1,2-diamine
CID 130523879
1-(2,4-dimethoxyanilino)-3-pyrazol-1-ylpropan-2-ol
CID 60898605
1-(2,5-dimethoxyanilino)-3-pyrazol-1-ylpropan-2-ol
CID 60898666
1-(4-bromo-3-methoxyanilino)-3-pyrazol-1-ylpropan-2-ol
CID 82868105

Frequently Asked Questions

What is the IUPAC name of 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
The IUPAC name of 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol (CID 114253550) is 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol.
What is the SMILES notation for 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
The canonical SMILES for 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol is Cc1cc(NCC(O)Cn2cccn2)nn1C.
What is the InChIKey of 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
The InChIKey is OTMPGMZOOFWDIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-9-6-11(14-15(9)2)12-7-10(17)8-16-5-3-4-13-16/h3-6,10,17H,7-8H2,1-2H3,(H,12,14).
What are the key properties of 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol?
1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol has a molecular weight of 235.29 g/mol, XLogP of 0.40, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1,5-dimethylpyrazol-3-yl)amino]-3-pyrazol-1-ylpropan-2-ol is sourced from PubChem (CID 114253550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).