1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine

C11H14ClNO — CID 106819817

IUPAC1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine
SMILESCOc1cc(Cl)ccc1C1(N)CC1C
InChIInChI=1S/C11H14ClNO/c1-7-6-11(7,13)9-4-3-8(12)5-10(9)14-2/h3-5,7H,6,13H2,1-2H3
InChIKeyLZXBMOXOXCUBTC-UHFFFAOYSA-N
MW211.69 g/mol
LogP2.54
Rot. Bonds2

About 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine

1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine (PubChem CID 106819817) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine.

Molecular Properties

Compound Name1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine
PubChem CID106819817
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine
SMILESCOc1cc(Cl)ccc1C1(N)CC1C
InChIInChI=1S/C11H14ClNO/c1-7-6-11(7,13)9-4-3-8(12)5-10(9)14-2/h3-5,7H,6,13H2,1-2H3
InChIKeyLZXBMOXOXCUBTC-UHFFFAOYSA-N
XLogP2.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chloro-2-methoxyphenyl)-2-ethylcyclopropan-1-amine
CID 106819818
1-(4-chloro-2-methoxyphenyl)-2-propylcyclopropan-1-amine
CID 106819819
[1-(5-chloro-2-methoxyphenyl)-2-methylcyclopropyl]methanol
CID 116842455
1-(5-chloro-2-methoxyphenyl)-2,2-dimethylcyclopropan-1-amine
CID 83692070
3-(5-chloro-2-methoxyphenyl)-3-fluorocyclobutan-1-amine
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1-(5-chloro-2-methoxyphenyl)cyclobutan-1-amine
CID 43146587
1-(5-chloro-2-methoxyphenyl)-3-phenylcyclobutan-1-amine
CID 65014865
1-[2-(4-chloro-2-methoxyphenyl)ethyl]cyclopropan-1-amine
CID 105483503
3-(4-chloro-2-methoxyphenoxy)azetidine
CID 131025612
2-(5-chloro-2-methoxyphenyl)spiro[3.4]octan-2-amine
CID 65002776
(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclopropyl)methanamine
CID 107001396
4-chloro-2-methoxy-1-methylbenzene;ethane
CID 143462337

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine?
The IUPAC name of 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine (CID 106819817) is 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine.
What is the SMILES notation for 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine?
The canonical SMILES for 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine is COc1cc(Cl)ccc1C1(N)CC1C.
What is the InChIKey of 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine?
The InChIKey is LZXBMOXOXCUBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-7-6-11(7,13)9-4-3-8(12)5-10(9)14-2/h3-5,7H,6,13H2,1-2H3.
What are the key properties of 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine?
1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine has a molecular weight of 211.69 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-2-methoxyphenyl)-2-methylcyclopropan-1-amine is sourced from PubChem (CID 106819817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).