(1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone

C19H17NO — CID 62877077

IUPAC(1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone
SMILESCn1cc(C(=O)C2(c3ccccc3)CC2)c2ccccc21
InChIInChI=1S/C19H17NO/c1-20-13-16(15-9-5-6-10-17(15)20)18(21)19(11-12-19)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3
InChIKeyOLRMYASXKXUGEN-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.09
Rot. Bonds3

About (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone

(1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone (PubChem CID 62877077) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name(1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone
PubChem CID62877077
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name(1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone
SMILESCn1cc(C(=O)C2(c3ccccc3)CC2)c2ccccc21
InChIInChI=1S/C19H17NO/c1-20-13-16(15-9-5-6-10-17(15)20)18(21)19(11-12-19)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3
InChIKeyOLRMYASXKXUGEN-UHFFFAOYSA-N
XLogP4.09
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone?
The IUPAC name of (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone (CID 62877077) is (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone.
What is the SMILES notation for (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone?
The canonical SMILES for (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone is Cn1cc(C(=O)C2(c3ccccc3)CC2)c2ccccc21.
What is the InChIKey of (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone?
The InChIKey is OLRMYASXKXUGEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO/c1-20-13-16(15-9-5-6-10-17(15)20)18(21)19(11-12-19)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3.
What are the key properties of (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone?
(1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone has a molecular weight of 275.35 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylindol-3-yl)-(1-phenylcyclopropyl)methanone is sourced from PubChem (CID 62877077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).