1-(4-methylindol-1-yl)propan-2-ol

C12H15NO — CID 10631504

IUPAC1-(4-methylindol-1-yl)propan-2-ol
SMILESCc1cccc2c1ccn2CC(C)O
InChIInChI=1S/C12H15NO/c1-9-4-3-5-12-11(9)6-7-13(12)8-10(2)14/h3-7,10,14H,8H2,1-2H3
InChIKeyZLTMBEOKYULAHF-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.33
Rot. Bonds2

About 1-(4-methylindol-1-yl)propan-2-ol

1-(4-methylindol-1-yl)propan-2-ol (PubChem CID 10631504) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-(4-methylindol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(4-methylindol-1-yl)propan-2-ol
PubChem CID10631504
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name1-(4-methylindol-1-yl)propan-2-ol
SMILESCc1cccc2c1ccn2CC(C)O
InChIInChI=1S/C12H15NO/c1-9-4-3-5-12-11(9)6-7-13(12)8-10(2)14/h3-7,10,14H,8H2,1-2H3
InChIKeyZLTMBEOKYULAHF-UHFFFAOYSA-N
XLogP2.33
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylindol-1-yl)propan-2-ol?
The IUPAC name of 1-(4-methylindol-1-yl)propan-2-ol (CID 10631504) is 1-(4-methylindol-1-yl)propan-2-ol.
What is the SMILES notation for 1-(4-methylindol-1-yl)propan-2-ol?
The canonical SMILES for 1-(4-methylindol-1-yl)propan-2-ol is Cc1cccc2c1ccn2CC(C)O.
What is the InChIKey of 1-(4-methylindol-1-yl)propan-2-ol?
The InChIKey is ZLTMBEOKYULAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-9-4-3-5-12-11(9)6-7-13(12)8-10(2)14/h3-7,10,14H,8H2,1-2H3.
What are the key properties of 1-(4-methylindol-1-yl)propan-2-ol?
1-(4-methylindol-1-yl)propan-2-ol has a molecular weight of 189.26 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylindol-1-yl)propan-2-ol is sourced from PubChem (CID 10631504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).