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

C14H20N2 — CID 116950726

IUPAC1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
SMILESCNC(c1ccc2c(c1)CCC2)C1CNC1
InChIInChI=1S/C14H20N2/c1-15-14(13-8-16-9-13)12-6-5-10-3-2-4-11(10)7-12/h5-7,13-16H,2-4,8-9H2,1H3
InChIKeyZULBSJOPDXBQBI-UHFFFAOYSA-N
MW216.33 g/mol
LogP1.66
Rot. Bonds3

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

1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine (PubChem CID 116950726) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
PubChem CID116950726
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
SMILESCNC(c1ccc2c(c1)CCC2)C1CNC1
InChIInChI=1S/C14H20N2/c1-15-14(13-8-16-9-13)12-6-5-10-3-2-4-11(10)7-12/h5-7,13-16H,2-4,8-9H2,1H3
InChIKeyZULBSJOPDXBQBI-UHFFFAOYSA-N
XLogP1.66
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
CID 106892701
1-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1-(3-methylcyclopentyl)methanamine
CID 114194414
1-bromo-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
CID 116961881
1-(3,4-dihydro-2H-thiochromen-6-yl)-N-methyl-1-pyrrolidin-3-ylmethanamine
CID 116951094
N-methyl-1-(2-methylcyclopentyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 107177156
N,N'-dimethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanediamine
CID 116954289
1-(azetidin-3-yl)-1-(4-methoxy-3-methylphenyl)-N-methylmethanamine
CID 116950716
3-[1-(2,3-dihydro-1H-inden-5-yl)propyl]pyrrolidine
CID 83911483
2-cyclobutyl-1-(2,3-dihydro-1H-inden-5-yl)-N-methylethanamine
CID 115863683
1-(azetidin-3-yl)-1-(4-ethoxy-3-methylphenyl)-N-methylmethanamine
CID 116950761
2-(methylamino)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 116961596
6-[methylamino(pyrrolidin-3-yl)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 116951044

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine (CID 116950726) is 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine is CNC(c1ccc2c(c1)CCC2)C1CNC1.
What is the InChIKey of 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine?
The InChIKey is ZULBSJOPDXBQBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-15-14(13-8-16-9-13)12-6-5-10-3-2-4-11(10)7-12/h5-7,13-16H,2-4,8-9H2,1H3.
What are the key properties of 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine?
1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine has a molecular weight of 216.33 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine is sourced from PubChem (CID 116950726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).