(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride

C10H12Cl3N — CID 171212549

IUPAC(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccc(Cl)cc1Cl)C1CC1
InChIInChI=1S/C10H11Cl2N.ClH/c11-7-3-4-8(9(12)5-7)10(13)6-1-2-6;/h3-6,10H,1-2,13H2;1H/t10-;/m1./s1
InChIKeyHEEDCPHDZJNVSY-HNCPQSOCSA-N
MW252.57 g/mol
LogP3.83
Rot. Bonds2

About (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride

(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride (PubChem CID 171212549) has the molecular formula C10H12Cl3N and a molecular weight of 252.57 g/mol. Its IUPAC name is (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride
PubChem CID171212549
Molecular FormulaC10H12Cl3N
Molecular Weight252.57 g/mol
Exact Mass251.00
IUPAC Name(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride
SMILESCl.N[C@@H](c1ccc(Cl)cc1Cl)C1CC1
InChIInChI=1S/C10H11Cl2N.ClH/c11-7-3-4-8(9(12)5-7)10(13)6-1-2-6;/h3-6,10H,1-2,13H2;1H/t10-;/m1./s1
InChIKeyHEEDCPHDZJNVSY-HNCPQSOCSA-N
XLogP3.83
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.57
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(R)-(2,4-dichlorophenyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171250540
4-[amino(cyclopropyl)methyl]-3-chloroaniline
CID 55268901
(2-chloro-4-methylphenyl)-cyclopropylmethanamine
CID 55268482
(S)-(4-bromo-2-chlorophenyl)-cyclopropylmethanamine
CID 130618338
2-[amino(cyclopropyl)methyl]-5-chloroaniline
CID 55270347
(2,4-dichlorophenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126530
(R)-(4-bromo-2-chlorophenyl)-cyclobutylmethanamine;hydrochloride
CID 171204069
2-[(S)-amino(cyclopropyl)methyl]-4,6-dichlorophenol;hydrochloride
CID 171217225
(2,4-dichlorophenyl)-(3-ethylcyclohexyl)methanamine
CID 104992313
(1R,2S)-2-amino-1-cyclopentyl-2-(2,4-dichlorophenyl)ethanol;hydrochloride
CID 171162618
(R)-cyclobutyl-(2,5-dichlorophenyl)methanamine
CID 130055186
(R)-(2-bromo-5-chlorophenyl)-cyclopropylmethanamine
CID 97290672

Frequently Asked Questions

What is the IUPAC name of (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride?
The IUPAC name of (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride (CID 171212549) is (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride.
What is the SMILES notation for (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride?
The canonical SMILES for (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride is Cl.N[C@@H](c1ccc(Cl)cc1Cl)C1CC1.
What is the InChIKey of (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride?
The InChIKey is HEEDCPHDZJNVSY-HNCPQSOCSA-N. The full InChI is InChI=1S/C10H11Cl2N.ClH/c11-7-3-4-8(9(12)5-7)10(13)6-1-2-6;/h3-6,10H,1-2,13H2;1H/t10-;/m1./s1.
What are the key properties of (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride?
(R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride has a molecular weight of 252.57 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-cyclopropyl-(2,4-dichlorophenyl)methanamine;hydrochloride is sourced from PubChem (CID 171212549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).