1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol

C10H16N2O — CID 62732009

IUPAC1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol
SMILESCCC(O)c1cnn(CC2CC2)c1
InChIInChI=1S/C10H16N2O/c1-2-10(13)9-5-11-12(7-9)6-8-3-4-8/h5,7-8,10,13H,2-4,6H2,1H3
InChIKeyAGMMFINYQSUHBU-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.74
Rot. Bonds4

About 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol

1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol (PubChem CID 62732009) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol.

Molecular Properties

Compound Name1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol
PubChem CID62732009
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol
SMILESCCC(O)c1cnn(CC2CC2)c1
InChIInChI=1S/C10H16N2O/c1-2-10(13)9-5-11-12(7-9)6-8-3-4-8/h5,7-8,10,13H,2-4,6H2,1H3
InChIKeyAGMMFINYQSUHBU-UHFFFAOYSA-N
XLogP1.74
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[(3,3-difluorocyclopentyl)methyl]pyrazol-4-yl]propan-1-ol
CID 114225169
1-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]propan-1-ol
CID 62730194
1-[1-(4-ethylcyclohexyl)pyrazol-4-yl]propan-1-ol
CID 64775504
1-[1-(cyclohexylmethyl)pyrazol-4-yl]ethanol
CID 62729638
1-[1-(oxan-4-ylmethyl)pyrazol-4-yl]ethanol
CID 62730914
3-cyclopropyl-1-(1-propylpyrazol-4-yl)propan-1-ol
CID 106590646
[1-(cyclopropylmethyl)pyrazol-4-yl]-(2,5-dimethyltriazol-4-yl)methanol
CID 167278885
4-(1-chloropropyl)-1-(oxan-4-ylmethyl)pyrazole
CID 62729493
[1-(cyclopropylmethyl)pyrazol-4-yl]-(3-iodo-1-methylpyrazol-4-yl)methanol
CID 164719164
1-[1-(cyclopropylmethyl)pyrazol-4-yl]butan-2-amine
CID 62731862
1-[1-(cyclopentylmethyl)pyrazol-4-yl]-N-propylpropan-1-amine
CID 62730353
2-amino-1-(1-ethylpyrazol-4-yl)ethanol
CID 55264385

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol?
The IUPAC name of 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol (CID 62732009) is 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol.
What is the SMILES notation for 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol?
The canonical SMILES for 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol is CCC(O)c1cnn(CC2CC2)c1.
What is the InChIKey of 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol?
The InChIKey is AGMMFINYQSUHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-10(13)9-5-11-12(7-9)6-8-3-4-8/h5,7-8,10,13H,2-4,6H2,1H3.
What are the key properties of 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol?
1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol has a molecular weight of 180.25 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclopropylmethyl)pyrazol-4-yl]propan-1-ol is sourced from PubChem (CID 62732009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).