1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine

C15H22N2 — CID 115207637

IUPAC1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine
SMILESCN(Cc1ccc2c(c1)CCC2)CC1CNC1
InChIInChI=1S/C15H22N2/c1-17(11-13-8-16-9-13)10-12-5-6-14-3-2-4-15(14)7-12/h5-7,13,16H,2-4,8-11H2,1H3
InChIKeyZWKSWYXDQYLXGA-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.83
Rot. Bonds4

About 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine

1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine (PubChem CID 115207637) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine
PubChem CID115207637
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine
SMILESCN(Cc1ccc2c(c1)CCC2)CC1CNC1
InChIInChI=1S/C15H22N2/c1-17(11-13-8-16-9-13)10-12-5-6-14-3-2-4-15(14)7-12/h5-7,13,16H,2-4,8-11H2,1H3
InChIKeyZWKSWYXDQYLXGA-UHFFFAOYSA-N
XLogP1.83
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-[1-(6-tert-butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)ethyl]-N,N-dimethylpropane-1,3-diamine
CID 3396601
1-(2,5-Dimethyl-benzyl)piperazine
CID 2758541
N-(azetidin-3-ylmethyl)-N-(naphthalen-2-ylmethyl)cyclopentanamine
CID 118713781
1,2,3,5,6,7-Hexahydro-N-(3-methylbutyl)-s-indacen-1-amine hydrochloride
CID 3058655
1,2,3,5,6,7-Hexahydro-N-ethyl-s-indacen-1-amine hydrochloride
CID 3058677
1-(3,4-Dimethylbenzyl)piperazine
CID 2737384
2-(2,5-Dimethylphenyl)pyrrolidine
CID 4715076
2-(3,4-Dimethylphenyl)pyrrolidine
CID 4715235
N,5-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 55264705
2-(2,6-Dimethylphenyl)azetidine
CID 55283012
(2-aminoethyl)((2,3-dihydro-1H-inden-5-yl)methyl)methylamine dihydrochloride
CID 155978111
1-(2,3-Dihydro-1H-inden-4-yl)-N-methylmethanamine hydrochloride
CID 156022653

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine?
The IUPAC name of 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine (CID 115207637) is 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine.
What is the SMILES notation for 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine?
The canonical SMILES for 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine is CN(Cc1ccc2c(c1)CCC2)CC1CNC1.
What is the InChIKey of 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine?
The InChIKey is ZWKSWYXDQYLXGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-17(11-13-8-16-9-13)10-12-5-6-14-3-2-4-15(14)7-12/h5-7,13,16H,2-4,8-11H2,1H3.
What are the key properties of 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine?
1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine has a molecular weight of 230.35 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-N-(2,3-dihydro-1H-inden-5-ylmethyl)-N-methylmethanamine is sourced from PubChem (CID 115207637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).