(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride

C17H20ClN — CID 171208431

IUPAC(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride
SMILESCl.N[C@H](CC1CC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H19N.ClH/c18-17(12-13-6-7-13)16-10-8-15(9-11-16)14-4-2-1-3-5-14;/h1-5,8-11,13,17H,6-7,12,18H2;1H/t17-;/m1./s1
InChIKeyKZIJMVDKQYKHJX-UNTBIKODSA-N
MW273.81 g/mol
LogP4.58
Rot. Bonds4

About (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride

(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride (PubChem CID 171208431) has the molecular formula C17H20ClN and a molecular weight of 273.81 g/mol. Its IUPAC name is (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride.

Molecular Properties

Compound Name(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride
PubChem CID171208431
Molecular FormulaC17H20ClN
Molecular Weight273.81 g/mol
Exact Mass273.13
IUPAC Name(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride
SMILESCl.N[C@H](CC1CC1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H19N.ClH/c18-17(12-13-6-7-13)16-10-8-15(9-11-16)14-4-2-1-3-5-14;/h1-5,8-11,13,17H,6-7,12,18H2;1H/t17-;/m1./s1
InChIKeyKZIJMVDKQYKHJX-UNTBIKODSA-N
XLogP4.58
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.81
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclobutyl-1-phenylethanamine;hydrochloride
CID 131675142
2-(oxolan-3-yl)-1-(4-phenylphenyl)ethanamine
CID 103986749
2-cyclopropyl-1-(4-methylphenyl)ethanamine
CID 22649613
2-cyclopropyl-1-(4-fluorophenyl)ethanamine;hydrochloride
CID 131637709
2-cyclopropyl-1-[4-[4-(trifluoromethyl)phenyl]phenyl]ethanamine
CID 67981332
2-cycloheptyl-1-phenylethanamine
CID 21261900
(1S)-1-(4-bromophenyl)-2-cyclopropylethanamine;hydrochloride
CID 171219224
(1R)-2-cyclopropyl-1-(4-fluorophenyl)ethanamine
CID 94248777
(1S)-2-cyclopropyl-1-(4-phenylmethoxyphenyl)ethanamine;hydrochloride
CID 171230778
(1S)-2-cyclopropyl-1-(4-ethylphenyl)ethanamine;hydrochloride
CID 171230824
(1S)-1-[4-(aminomethyl)phenyl]-2-cyclopropylethanamine
CID 150978200
(1R)-2-cyclopropyl-1-(4-methoxyphenyl)ethanamine;hydrochloride
CID 171200883

Frequently Asked Questions

What is the IUPAC name of (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride?
The IUPAC name of (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride (CID 171208431) is (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride.
What is the SMILES notation for (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride?
The canonical SMILES for (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride is Cl.N[C@H](CC1CC1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride?
The InChIKey is KZIJMVDKQYKHJX-UNTBIKODSA-N. The full InChI is InChI=1S/C17H19N.ClH/c18-17(12-13-6-7-13)16-10-8-15(9-11-16)14-4-2-1-3-5-14;/h1-5,8-11,13,17H,6-7,12,18H2;1H/t17-;/m1./s1.
What are the key properties of (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride?
(1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride has a molecular weight of 273.81 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-cyclopropyl-1-(4-phenylphenyl)ethanamine;hydrochloride is sourced from PubChem (CID 171208431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).