1-(cyclopropylmethyl)-4-phenylmethoxyindole

C19H19NO — CID 69006016

IUPAC1-(cyclopropylmethyl)-4-phenylmethoxyindole
SMILESc1ccc(COc2cccc3c2ccn3CC2CC2)cc1
InChIInChI=1S/C19H19NO/c1-2-5-16(6-3-1)14-21-19-8-4-7-18-17(19)11-12-20(18)13-15-9-10-15/h1-8,11-12,15H,9-10,13-14H2
InChIKeyKUYXVIULQHTBMV-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.63
Rot. Bonds5

About 1-(cyclopropylmethyl)-4-phenylmethoxyindole

1-(cyclopropylmethyl)-4-phenylmethoxyindole (PubChem CID 69006016) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4-phenylmethoxyindole.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-4-phenylmethoxyindole
PubChem CID69006016
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name1-(cyclopropylmethyl)-4-phenylmethoxyindole
SMILESc1ccc(COc2cccc3c2ccn3CC2CC2)cc1
InChIInChI=1S/C19H19NO/c1-2-5-16(6-3-1)14-21-19-8-4-7-18-17(19)11-12-20(18)13-15-9-10-15/h1-8,11-12,15H,9-10,13-14H2
InChIKeyKUYXVIULQHTBMV-UHFFFAOYSA-N
XLogP4.63
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropylmethyl)-4-ethoxyindole
CID 83173607
1-(bromomethyl)-4-phenylmethoxyindole
CID 59096925
1-ethyl-4-phenylmethoxyindole
CID 24776902
4-ethoxy-1-(oxan-4-ylmethyl)indole
CID 83174245
1-(2-naphthalen-1-yloxyethyl)-4-phenylmethoxyindole
CID 84571556
CID 59096793
CID 59096793
N,N-dimethyl-3-(4-phenylmethoxyindol-1-yl)propan-1-amine
CID 84571792
4-ethoxy-1-(phenylmethoxymethyl)indole
CID 102940706
4-phenylmethoxyindole-1-sulfinate
CID 23517350
1-(4-bromophenyl)-2-(4-phenylmethoxyindol-1-yl)ethanone
CID 84571777
1-(4-methylphenyl)-2-(4-phenylmethoxyindol-1-yl)ethanone
CID 84571772
1-(1-phenylethyl)-4-phenylmethoxyindole
CID 84571178

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-4-phenylmethoxyindole?
The IUPAC name of 1-(cyclopropylmethyl)-4-phenylmethoxyindole (CID 69006016) is 1-(cyclopropylmethyl)-4-phenylmethoxyindole.
What is the SMILES notation for 1-(cyclopropylmethyl)-4-phenylmethoxyindole?
The canonical SMILES for 1-(cyclopropylmethyl)-4-phenylmethoxyindole is c1ccc(COc2cccc3c2ccn3CC2CC2)cc1.
What is the InChIKey of 1-(cyclopropylmethyl)-4-phenylmethoxyindole?
The InChIKey is KUYXVIULQHTBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-2-5-16(6-3-1)14-21-19-8-4-7-18-17(19)11-12-20(18)13-15-9-10-15/h1-8,11-12,15H,9-10,13-14H2.
What are the key properties of 1-(cyclopropylmethyl)-4-phenylmethoxyindole?
1-(cyclopropylmethyl)-4-phenylmethoxyindole has a molecular weight of 277.37 g/mol, XLogP of 4.63, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-4-phenylmethoxyindole is sourced from PubChem (CID 69006016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).