1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol

C15H19N3O — CID 103006799

IUPAC1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
SMILESCn1cc(CCC(O)c2cccc3c2NCC3)cn1
InChIInChI=1S/C15H19N3O/c1-18-10-11(9-17-18)5-6-14(19)13-4-2-3-12-7-8-16-15(12)13/h2-4,9-10,14,16,19H,5-8H2,1H3
InChIKeyGZSDZONHURBYKB-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.05
Rot. Bonds4

About 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol

1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol (PubChem CID 103006799) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
PubChem CID103006799
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
SMILESCn1cc(CCC(O)c2cccc3c2NCC3)cn1
InChIInChI=1S/C15H19N3O/c1-18-10-11(9-17-18)5-6-14(19)13-4-2-3-12-7-8-16-15(12)13/h2-4,9-10,14,16,19H,5-8H2,1H3
InChIKeyGZSDZONHURBYKB-UHFFFAOYSA-N
XLogP2.05
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-bromophenyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103006091
1-(2-bromo-3-methylphenyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 114024293
1-(2-cyclopropylphenyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103006443
3-(1-methylpyrazol-4-yl)-1-(4-methylthiophen-3-yl)propan-1-ol
CID 103008373
1-(5-bromofuran-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103005951
1-(4-chlorophenyl)-N-(2,3-dihydro-1H-indol-7-ylmethyl)-N-[(1-methylpyrazol-4-yl)methyl]methanamine;hydrochloride
CID 120851953
3-(1-methylpyrazol-4-yl)-1-(4-methyl-2-pyridinyl)propan-1-ol
CID 103008136
8-[(1-methylpyrazol-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 54909171
2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114638224
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008155
1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103005986
1-(2,3-dichlorophenyl)-2-(1-methylpyrazol-4-yl)ethanol
CID 63895824

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
The IUPAC name of 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol (CID 103006799) is 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol.
What is the SMILES notation for 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
The canonical SMILES for 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol is Cn1cc(CCC(O)c2cccc3c2NCC3)cn1.
What is the InChIKey of 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
The InChIKey is GZSDZONHURBYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18-10-11(9-17-18)5-6-14(19)13-4-2-3-12-7-8-16-15(12)13/h2-4,9-10,14,16,19H,5-8H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol has a molecular weight of 257.34 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol is sourced from PubChem (CID 103006799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).