1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol

C15H17N3O — CID 114557062

IUPAC1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H17N3O/c1-2-9-18-14(6-8-17-18)15(19)12-3-4-13-11(10-12)5-7-16-13/h3-8,10,15-16,19H,2,9H2,1H3
InChIKeyMBQONZBLYQYIQI-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.86
Rot. Bonds4

About 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol

1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol (PubChem CID 114557062) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol
PubChem CID114557062
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H17N3O/c1-2-9-18-14(6-8-17-18)15(19)12-3-4-13-11(10-12)5-7-16-13/h3-8,10,15-16,19H,2,9H2,1H3
InChIKeyMBQONZBLYQYIQI-UHFFFAOYSA-N
XLogP2.86
TPSA53.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-ethylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 63976106
(3-bromo-4-fluorophenyl)-(2-propylpyrazol-3-yl)methanol
CID 63974840
(2-propylpyrazol-3-yl)-pyrimidin-5-ylmethanol
CID 114556923
furan-3-yl-(2-propylpyrazol-3-yl)methanol
CID 63974629
(3-fluoro-4-methoxyphenyl)-(2-propylpyrazol-3-yl)methanol
CID 65100970
(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 79980656
1H-indol-5-yl(phenyl)methanol
CID 19042833
(6-bromonaphthalen-2-yl)-(2-ethylpyrazol-3-yl)methanol
CID 115798794
(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol
CID 114557064
1-(1H-indol-5-yl)heptan-1-ol
CID 81444731
(2,5-dimethylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 63977386
(4-fluorophenyl)-(1H-indol-5-yl)methanol
CID 81444818

Frequently Asked Questions

What is the IUPAC name of 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol?
The IUPAC name of 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol (CID 114557062) is 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol.
What is the SMILES notation for 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol?
The canonical SMILES for 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol is CCCn1nccc1C(O)c1ccc2[nH]ccc2c1.
What is the InChIKey of 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol?
The InChIKey is MBQONZBLYQYIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-2-9-18-14(6-8-17-18)15(19)12-3-4-13-11(10-12)5-7-16-13/h3-8,10,15-16,19H,2,9H2,1H3.
What are the key properties of 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol?
1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol has a molecular weight of 255.32 g/mol, XLogP of 2.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 114557062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).