4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole

C16H24N2O — CID 115074436

IUPAC4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole
SMILESCN1CCC(C)(COc2cccc3c2CCN3)CC1
InChIInChI=1S/C16H24N2O/c1-16(7-10-18(2)11-8-16)12-19-15-5-3-4-14-13(15)6-9-17-14/h3-5,17H,6-12H2,1-2H3
InChIKeyLMMLGHKEZVIYBC-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.77
Rot. Bonds3

About 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole

4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole (PubChem CID 115074436) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole
PubChem CID115074436
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole
SMILESCN1CCC(C)(COc2cccc3c2CCN3)CC1
InChIInChI=1S/C16H24N2O/c1-16(7-10-18(2)11-8-16)12-19-15-5-3-4-14-13(15)6-9-17-14/h3-5,17H,6-12H2,1-2H3
InChIKeyLMMLGHKEZVIYBC-UHFFFAOYSA-N
XLogP2.77
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(1,4-dimethylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075159
4-[(1,4,4-trimethylcyclohexyl)methoxy]-2,3-dihydro-1H-indole
CID 115074397
4-[(1,3,3-trimethylcyclopentyl)methoxy]-2,3-dihydro-1H-indole
CID 115074393
4-[(3-methylpyrrolidin-3-yl)methoxy]-2,3-dihydro-1H-indole
CID 115074421
5-[(1,4,4-trimethylcyclohexyl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075120
5-[(1-ethyl-3-methylazetidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075103
8-[(1,3-dimethylpyrrolidin-3-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075679
5-[(1-methylpiperidin-4-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075157
5-[(1-methylcyclohexyl)methoxy]-1,2,3,4-tetrahydroisoquinoline
CID 115076115
4-(1-methylcyclobutyl)oxy-2,3-dihydro-1H-indole
CID 115074311
5-[(2-methyloxolan-2-yl)methoxy]-1,2,3,4-tetrahydroquinoline
CID 115075064
4-(4-methylpiperidin-4-yl)oxy-2,3-dihydro-1H-indole
CID 115074334

Frequently Asked Questions

What is the IUPAC name of 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole?
The IUPAC name of 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole (CID 115074436) is 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole.
What is the SMILES notation for 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole?
The canonical SMILES for 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole is CN1CCC(C)(COc2cccc3c2CCN3)CC1.
What is the InChIKey of 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole?
The InChIKey is LMMLGHKEZVIYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-16(7-10-18(2)11-8-16)12-19-15-5-3-4-14-13(15)6-9-17-14/h3-5,17H,6-12H2,1-2H3.
What are the key properties of 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole?
4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole has a molecular weight of 260.38 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1,4-dimethylpiperidin-4-yl)methoxy]-2,3-dihydro-1H-indole is sourced from PubChem (CID 115074436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).