[2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol

C14H17N3O — CID 113380558

IUPAC[2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol
SMILESCCc1cc(CO)cc(-n2ccc(C3CC3)n2)n1
InChIInChI=1S/C14H17N3O/c1-2-12-7-10(9-18)8-14(15-12)17-6-5-13(16-17)11-3-4-11/h5-8,11,18H,2-4,9H2,1H3
InChIKeyMRLVSIRHIKUCGU-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.20
Rot. Bonds4

About [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol

[2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol (PubChem CID 113380558) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol
PubChem CID113380558
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name[2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol
SMILESCCc1cc(CO)cc(-n2ccc(C3CC3)n2)n1
InChIInChI=1S/C14H17N3O/c1-2-12-7-10(9-18)8-14(15-12)17-6-5-13(16-17)11-3-4-11/h5-8,11,18H,2-4,9H2,1H3
InChIKeyMRLVSIRHIKUCGU-UHFFFAOYSA-N
XLogP2.20
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol?
The IUPAC name of [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol (CID 113380558) is [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol.
What is the SMILES notation for [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol?
The canonical SMILES for [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol is CCc1cc(CO)cc(-n2ccc(C3CC3)n2)n1.
What is the InChIKey of [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol?
The InChIKey is MRLVSIRHIKUCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-2-12-7-10(9-18)8-14(15-12)17-6-5-13(16-17)11-3-4-11/h5-8,11,18H,2-4,9H2,1H3.
What are the key properties of [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol?
[2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol has a molecular weight of 243.31 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-cyclopropylpyrazol-1-yl)-6-ethyl-4-pyridinyl]methanol is sourced from PubChem (CID 113380558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).