(1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone

C11H12ClNO2 — CID 130730363

IUPAC(1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone
SMILESCOc1cccc(Cl)c1C(=O)C1(N)CC1
InChIInChI=1S/C11H12ClNO2/c1-15-8-4-2-3-7(12)9(8)10(14)11(13)5-6-11/h2-4H,5-6,13H2,1H3
InChIKeyARTWWQDBGGWUBL-UHFFFAOYSA-N
MW225.68 g/mol
LogP2.02
Rot. Bonds3

About (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone

(1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone (PubChem CID 130730363) has the molecular formula C11H12ClNO2 and a molecular weight of 225.68 g/mol. Its IUPAC name is (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone.

Molecular Properties

Compound Name(1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone
PubChem CID130730363
Molecular FormulaC11H12ClNO2
Molecular Weight225.68 g/mol
Exact Mass225.06
IUPAC Name(1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone
SMILESCOc1cccc(Cl)c1C(=O)C1(N)CC1
InChIInChI=1S/C11H12ClNO2/c1-15-8-4-2-3-7(12)9(8)10(14)11(13)5-6-11/h2-4H,5-6,13H2,1H3
InChIKeyARTWWQDBGGWUBL-UHFFFAOYSA-N
XLogP2.02
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.68
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-aminocyclopropyl)-(2,6-dimethoxyphenyl)methanone
CID 116811529
1-(2-chloro-6-methoxyphenyl)ethanone
CID 71464357
(1-aminocyclopropyl)-(3-methoxyphenyl)methanone
CID 116576589
(1-aminocyclopropyl)-(2-chloro-4-methoxyphenyl)methanone
CID 116924320
(1-aminocyclopropyl)-(2,3-dichloro-4-methoxyphenyl)methanone
CID 116924357
2-(2-chloro-6-methoxyphenyl)-2-oxoacetic acid
CID 117305827
[1-(2,6-dichlorobenzoyl)cyclohexyl]-(2,6-dimethoxybenzoyl)-oxophosphanium
CID 173195007
(1-aminocyclopropyl)-(2-chlorophenyl)methanone
CID 116576455
lithium [3-(2-chloro-6-methoxyphenyl)-3-oxopropyl]phosphanide
CID 141023114
1-(2-chloro-6-methoxyphenyl)-2,2-difluoropropan-1-one
CID 131187635
(1-aminocyclopropyl)-(4-methoxy-3-propan-2-ylphenyl)methanone
CID 116924282
CID 159993809
CID 159993809

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone?
The IUPAC name of (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone (CID 130730363) is (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone.
What is the SMILES notation for (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone?
The canonical SMILES for (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone is COc1cccc(Cl)c1C(=O)C1(N)CC1.
What is the InChIKey of (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone?
The InChIKey is ARTWWQDBGGWUBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClNO2/c1-15-8-4-2-3-7(12)9(8)10(14)11(13)5-6-11/h2-4H,5-6,13H2,1H3.
What are the key properties of (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone?
(1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone has a molecular weight of 225.68 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopropyl)-(2-chloro-6-methoxyphenyl)methanone is sourced from PubChem (CID 130730363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).