6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole

C15H14ClNO — CID 115103937

IUPAC6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole
SMILESClc1ccccc1OCc1ccc2c(c1)NCC2
InChIInChI=1S/C15H14ClNO/c16-13-3-1-2-4-15(13)18-10-11-5-6-12-7-8-17-14(12)9-11/h1-6,9,17H,7-8,10H2
InChIKeyLEQFVSVRPOMTFM-UHFFFAOYSA-N
MW259.74 g/mol
LogP3.89
Rot. Bonds3

About 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole

6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole (PubChem CID 115103937) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole
PubChem CID115103937
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC Name6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole
SMILESClc1ccccc1OCc1ccc2c(c1)NCC2
InChIInChI=1S/C15H14ClNO/c16-13-3-1-2-4-15(13)18-10-11-5-6-12-7-8-17-14(12)9-11/h1-6,9,17H,7-8,10H2
InChIKeyLEQFVSVRPOMTFM-UHFFFAOYSA-N
XLogP3.89
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[(2-chlorophenoxy)methyl]-1,2,3,4-tetrahydroquinoline
CID 115104384
5-[(2-methylphenoxy)methyl]-2,3-dihydro-1H-indole
CID 115103966
6-phenylmethoxy-2,3-dihydro-1H-indole
CID 18932839
4-[(2-chlorophenoxy)methyl]-1,2-dimethoxybenzene
CID 64763618
2-amino-4-[(2-chlorophenoxy)methyl]phenol
CID 117221784
2-bromo-5-[(2-chlorophenoxy)methyl]phenol
CID 117220261
5-chloro-7-phenylmethoxy-2,3-dihydro-1H-indole
CID 14849556
6-[(2-fluorophenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline
CID 115104179
3-(2,3-dihydro-1H-indol-6-yl)propan-1-amine
CID 115105426
magnesium;1-chloro-2-(phenylmethoxy)benzene;bromide
CID 91655253
2-(2,3-dihydro-1H-indol-6-yl)-N,N-dimethylethanamine
CID 115105305
2-[3-[(2-chlorophenoxy)methyl]phenyl]isoindole-1,3-dione
CID 168518591

Frequently Asked Questions

What is the IUPAC name of 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole?
The IUPAC name of 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole (CID 115103937) is 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole.
What is the SMILES notation for 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole?
The canonical SMILES for 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole is Clc1ccccc1OCc1ccc2c(c1)NCC2.
What is the InChIKey of 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole?
The InChIKey is LEQFVSVRPOMTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO/c16-13-3-1-2-4-15(13)18-10-11-5-6-12-7-8-17-14(12)9-11/h1-6,9,17H,7-8,10H2.
What are the key properties of 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole?
6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole has a molecular weight of 259.74 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-chlorophenoxy)methyl]-2,3-dihydro-1H-indole is sourced from PubChem (CID 115103937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).