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

C8H15N3O — CID 130502735

IUPAC2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol
SMILESCc1cc(NC(C)CO)nn1C
InChIInChI=1S/C8H15N3O/c1-6(5-12)9-8-4-7(2)11(3)10-8/h4,6,12H,5H2,1-3H3,(H,9,10)
InChIKeyLCQWFFMWNAXOFY-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.52
Rot. Bonds3

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

2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol (PubChem CID 130502735) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol.

Molecular Properties

Compound Name2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol
PubChem CID130502735
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol
SMILESCc1cc(NC(C)CO)nn1C
InChIInChI=1S/C8H15N3O/c1-6(5-12)9-8-4-7(2)11(3)10-8/h4,6,12H,5H2,1-3H3,(H,9,10)
InChIKeyLCQWFFMWNAXOFY-UHFFFAOYSA-N
XLogP0.52
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-hex-5-en-2-yl-1,5-dimethylpyrazol-3-amine
CID 104583972
N-heptan-4-yl-1,5-dimethylpyrazol-3-amine
CID 115922057
N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine
CID 115922045
2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]propan-1-ol
CID 80780227
N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine
CID 130607965
1,5-dimethyl-N-[1-(5-methylfuran-2-yl)ethyl]pyrazol-3-amine
CID 115922058
1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine
CID 115922060
(2R)-1-N-(1,5-dimethylpyrazol-3-yl)-3-methylbutane-1,2-diamine
CID 130523879
(2S)-N-(1,5-dimethylpyrazol-3-yl)-2-(methylamino)propanamide
CID 126982193
2-bromo-N-(1,5-dimethylpyrazol-3-yl)acetamide
CID 130496766
1,5-dimethyl-N-[1-(1,3-thiazol-5-yl)ethyl]pyrazol-3-amine
CID 115922073
2-[(1,3-dimethylpyrazol-4-yl)amino]propan-1-ol
CID 130502699

Frequently Asked Questions

What is the IUPAC name of 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol?
The IUPAC name of 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol (CID 130502735) is 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol.
What is the SMILES notation for 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol?
The canonical SMILES for 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol is Cc1cc(NC(C)CO)nn1C.
What is the InChIKey of 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol?
The InChIKey is LCQWFFMWNAXOFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-6(5-12)9-8-4-7(2)11(3)10-8/h4,6,12H,5H2,1-3H3,(H,9,10).
What are the key properties of 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol?
2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol has a molecular weight of 169.23 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol is sourced from PubChem (CID 130502735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).