(R)-cyclobutyl-(2,5-dichlorophenyl)methanamine

C11H13Cl2N — CID 130055186

IUPAC(R)-cyclobutyl-(2,5-dichlorophenyl)methanamine
SMILESN[C@@H](c1cc(Cl)ccc1Cl)C1CCC1
InChIInChI=1S/C11H13Cl2N/c12-8-4-5-10(13)9(6-8)11(14)7-2-1-3-7/h4-7,11H,1-3,14H2/t11-/m1/s1
InChIKeyCVMFTKPYMFJHEN-LLVKDONJSA-N
MW230.14 g/mol
LogP3.79
Rot. Bonds2

About (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine

(R)-cyclobutyl-(2,5-dichlorophenyl)methanamine (PubChem CID 130055186) has the molecular formula C11H13Cl2N and a molecular weight of 230.14 g/mol. Its IUPAC name is (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine.

Molecular Properties

Compound Name(R)-cyclobutyl-(2,5-dichlorophenyl)methanamine
PubChem CID130055186
Molecular FormulaC11H13Cl2N
Molecular Weight230.14 g/mol
Exact Mass229.04
IUPAC Name(R)-cyclobutyl-(2,5-dichlorophenyl)methanamine
SMILESN[C@@H](c1cc(Cl)ccc1Cl)C1CCC1
InChIInChI=1S/C11H13Cl2N/c12-8-4-5-10(13)9(6-8)11(14)7-2-1-3-7/h4-7,11H,1-3,14H2/t11-/m1/s1
InChIKeyCVMFTKPYMFJHEN-LLVKDONJSA-N
XLogP3.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.14
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5-bromo-2-chlorophenyl)-cyclobutylmethanamine
CID 112631034
(S)-(2-chloro-5-fluorophenyl)-cyclopentylmethanamine
CID 131512229
(2,5-dichlorophenyl)-(4,4-difluorocyclohexyl)methanamine
CID 105142294
2-[(S)-amino(cyclobutyl)methyl]-4-chlorophenol;hydrochloride
CID 171217140
(S)-(2-bromo-5-chlorophenyl)-cyclobutylmethanamine;hydrochloride
CID 171223307
2-[(S)-amino(cyclopentyl)methyl]-4-chloroaniline
CID 171233850
2-[(R)-amino(cyclopentyl)methyl]-4-chloroaniline
CID 171214222
(2-bromo-4-chlorophenyl)-cyclobutylmethanamine
CID 103947074
(R)-(5-chloro-2-fluorophenyl)-cyclohexylmethanamine;hydrochloride
CID 171202097
(2,5-dichlorophenyl)-(4-propylcyclohexyl)methanamine
CID 65423953
(2-chloro-4,5-dimethylphenyl)-cyclobutylmethanamine
CID 115483752
(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride
CID 171212549

Frequently Asked Questions

What is the IUPAC name of (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine?
The IUPAC name of (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine (CID 130055186) is (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine.
What is the SMILES notation for (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine?
The canonical SMILES for (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine is N[C@@H](c1cc(Cl)ccc1Cl)C1CCC1.
What is the InChIKey of (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine?
The InChIKey is CVMFTKPYMFJHEN-LLVKDONJSA-N. The full InChI is InChI=1S/C11H13Cl2N/c12-8-4-5-10(13)9(6-8)11(14)7-2-1-3-7/h4-7,11H,1-3,14H2/t11-/m1/s1.
What are the key properties of (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine?
(R)-cyclobutyl-(2,5-dichlorophenyl)methanamine has a molecular weight of 230.14 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclobutyl-(2,5-dichlorophenyl)methanamine is sourced from PubChem (CID 130055186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).