1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride

C11H16ClNO — CID 75361270

IUPAC1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride
SMILESCOc1ccc(CC2(N)CC2)cc1.Cl
InChIInChI=1S/C11H15NO.ClH/c1-13-10-4-2-9(3-5-10)8-11(12)6-7-11;/h2-5H,6-8,12H2,1H3;1H
InChIKeyJSEXSOVTVGEQPW-UHFFFAOYSA-N
MW213.71 g/mol
LogP2.15
Rot. Bonds3

About 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride

1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride (PubChem CID 75361270) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride
PubChem CID75361270
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Name1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride
SMILESCOc1ccc(CC2(N)CC2)cc1.Cl
InChIInChI=1S/C11H15NO.ClH/c1-13-10-4-2-9(3-5-10)8-11(12)6-7-11;/h2-5H,6-8,12H2,1H3;1H
InChIKeyJSEXSOVTVGEQPW-UHFFFAOYSA-N
XLogP2.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(4-methoxyphenyl)methyl]-2-methylcyclopropan-1-amine;hydrochloride
CID 71756717
1-[(4-iodophenyl)methyl]cyclopropan-1-amine
CID 58506888
1-[(4-methoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 69475295
1-[[4-(2-methylpropyl)phenyl]methyl]cyclopropan-1-amine
CID 116932038
1-[[4-(2,2-dimethylpropyl)phenyl]methyl]cyclopropan-1-amine
CID 117310114
1-methoxy-4-[(1-methoxy-4-methylcyclohexyl)methyl]benzene
CID 70921631
3-[(4-methoxyphenyl)methyl]oxetan-3-ol
CID 83685421
3-[(4-methoxyphenyl)methyl]azetidin-3-ol
CID 83685225
1-[(4-cyclopropyl-3-methoxyphenyl)methyl]cyclopropan-1-amine
CID 117309842
[1-[(6-methoxynaphthalen-2-yl)methyl]cyclopropyl]methanamine
CID 116929036
1-[(4-methoxyphenyl)methyl]cyclohexane-1-carboxylic acid
CID 22660130
ethanamine;1-methoxy-4-propylbenzene
CID 19382800

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride?
The IUPAC name of 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride (CID 75361270) is 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride.
What is the SMILES notation for 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride?
The canonical SMILES for 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride is COc1ccc(CC2(N)CC2)cc1.Cl.
What is the InChIKey of 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride?
The InChIKey is JSEXSOVTVGEQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.ClH/c1-13-10-4-2-9(3-5-10)8-11(12)6-7-11;/h2-5H,6-8,12H2,1H3;1H.
What are the key properties of 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride?
1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride has a molecular weight of 213.71 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxyphenyl)methyl]cyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 75361270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).