(R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine

C11H14ClN — CID 55278008

IUPAC(R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine
SMILESCc1cc(Cl)cc([C@H](N)C2CC2)c1
InChIInChI=1S/C11H14ClN/c1-7-4-9(6-10(12)5-7)11(13)8-2-3-8/h4-6,8,11H,2-3,13H2,1H3/t11-/m1/s1
InChIKeyCMHQFWSUKJOLCF-LLVKDONJSA-N
MW195.69 g/mol
LogP3.06
Rot. Bonds2

About (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine

(R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine (PubChem CID 55278008) has the molecular formula C11H14ClN and a molecular weight of 195.69 g/mol. Its IUPAC name is (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine.

Molecular Properties

Compound Name(R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine
PubChem CID55278008
Molecular FormulaC11H14ClN
Molecular Weight195.69 g/mol
Exact Mass195.08
IUPAC Name(R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine
SMILESCc1cc(Cl)cc([C@H](N)C2CC2)c1
InChIInChI=1S/C11H14ClN/c1-7-4-9(6-10(12)5-7)11(13)8-2-3-8/h4-6,8,11H,2-3,13H2,1H3/t11-/m1/s1
InChIKeyCMHQFWSUKJOLCF-LLVKDONJSA-N
XLogP3.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.69
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3,5-dimethylphenyl)-(4-methylcyclohexyl)methanamine
CID 63415986
(S)-cyclobutyl-(3,5-dimethylphenyl)methanamine
CID 130055056
cyclohexyl-(3,5-dichlorophenyl)methanamine
CID 114981427
(3,5-dimethylphenyl)-(4-ethylcyclohexyl)methanamine
CID 65395177
(R)-(3,5-dichlorophenyl)-(oxan-4-yl)methanamine
CID 131424758
(R)-cyclobutyl-(3-fluoro-5-methylphenyl)methanamine
CID 130054445
2-(3-chloro-5-methylphenyl)-2-cyclopropylacetic acid
CID 175668595
(3-bromo-5-methylphenyl)-cyclobutylmethanamine
CID 112631023
(3,4-dimethylcyclohexyl)-(3,5-dimethylphenyl)methanamine
CID 104989109
3-[(R)-amino(cyclobutyl)methyl]-5-methylphenol
CID 131036736
(S)-cyclopropyl-(3-methylphenyl)methanamine;hydrochloride
CID 171229489
(S)-(3-chloro-5-fluorophenyl)-(oxan-4-yl)methanamine
CID 131582090

Frequently Asked Questions

What is the IUPAC name of (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine?
The IUPAC name of (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine (CID 55278008) is (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine.
What is the SMILES notation for (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine?
The canonical SMILES for (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine is Cc1cc(Cl)cc([C@H](N)C2CC2)c1.
What is the InChIKey of (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine?
The InChIKey is CMHQFWSUKJOLCF-LLVKDONJSA-N. The full InChI is InChI=1S/C11H14ClN/c1-7-4-9(6-10(12)5-7)11(13)8-2-3-8/h4-6,8,11H,2-3,13H2,1H3/t11-/m1/s1.
What are the key properties of (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine?
(R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine has a molecular weight of 195.69 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(3-chloro-5-methylphenyl)-cyclopropylmethanamine is sourced from PubChem (CID 55278008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).