[2-(2-chlorophenyl)azetidin-2-yl]methanamine

C10H13ClN2 — CID 115059255

IUPAC[2-(2-chlorophenyl)azetidin-2-yl]methanamine
SMILESNCC1(c2ccccc2Cl)CCN1
InChIInChI=1S/C10H13ClN2/c11-9-4-2-1-3-8(9)10(7-12)5-6-13-10/h1-4,13H,5-7,12H2
InChIKeyUHKBGXAPKXDPOZ-UHFFFAOYSA-N
MW196.68 g/mol
LogP1.49
Rot. Bonds2

About [2-(2-chlorophenyl)azetidin-2-yl]methanamine

[2-(2-chlorophenyl)azetidin-2-yl]methanamine (PubChem CID 115059255) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is [2-(2-chlorophenyl)azetidin-2-yl]methanamine.

Molecular Properties

Compound Name[2-(2-chlorophenyl)azetidin-2-yl]methanamine
PubChem CID115059255
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name[2-(2-chlorophenyl)azetidin-2-yl]methanamine
SMILESNCC1(c2ccccc2Cl)CCN1
InChIInChI=1S/C10H13ClN2/c11-9-4-2-1-3-8(9)10(7-12)5-6-13-10/h1-4,13H,5-7,12H2
InChIKeyUHKBGXAPKXDPOZ-UHFFFAOYSA-N
XLogP1.49
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine
CID 115058529
[1-(2-chlorophenyl)cyclopropyl]methanamine;hydrochloride
CID 46736468
2-[2-(aminomethyl)pyrrolidin-2-yl]phenol
CID 115059279
2-(2-chlorophenyl)-2-(methoxymethyl)pyrrolidine
CID 117271928
[1-(2-chlorophenyl)-3,3-difluorocyclopentyl]methanamine
CID 115045654
2-(2-chlorophenyl)-4,4-difluoro-2-methylpiperidine
CID 115045643
4-(2-chlorophenyl)-4-(difluoromethyl)piperidine
CID 84737369
2-(2-phenylazetidin-2-yl)ethanamine
CID 115059318
[2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine
CID 65006500
tert-butyl N-[[2-(2-chlorophenyl)pyrrolidin-2-yl]methyl]carbamate
CID 115059198
1-chloro-2-[1-(2-chlorophenyl)cyclopentyl]benzene
CID 142095779
1-[1-(2-chlorophenyl)cyclopropyl]cyclopropan-1-amine
CID 83673850

Frequently Asked Questions

What is the IUPAC name of [2-(2-chlorophenyl)azetidin-2-yl]methanamine?
The IUPAC name of [2-(2-chlorophenyl)azetidin-2-yl]methanamine (CID 115059255) is [2-(2-chlorophenyl)azetidin-2-yl]methanamine.
What is the SMILES notation for [2-(2-chlorophenyl)azetidin-2-yl]methanamine?
The canonical SMILES for [2-(2-chlorophenyl)azetidin-2-yl]methanamine is NCC1(c2ccccc2Cl)CCN1.
What is the InChIKey of [2-(2-chlorophenyl)azetidin-2-yl]methanamine?
The InChIKey is UHKBGXAPKXDPOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2/c11-9-4-2-1-3-8(9)10(7-12)5-6-13-10/h1-4,13H,5-7,12H2.
What are the key properties of [2-(2-chlorophenyl)azetidin-2-yl]methanamine?
[2-(2-chlorophenyl)azetidin-2-yl]methanamine has a molecular weight of 196.68 g/mol, XLogP of 1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chlorophenyl)azetidin-2-yl]methanamine is sourced from PubChem (CID 115059255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).