N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine

C18H23N — CID 40561608

IUPACN-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine
SMILESCC(C)CN[C@H](Cc1ccccc1)c1ccccc1
InChIInChI=1S/C18H23N/c1-15(2)14-19-18(17-11-7-4-8-12-17)13-16-9-5-3-6-10-16/h3-12,15,18-19H,13-14H2,1-2H3/t18-/m1/s1
InChIKeyMDCAXCVWFHKLAO-GOSISDBHSA-N
MW253.39 g/mol
LogP4.22
Rot. Bonds6

About N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine

N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine (PubChem CID 40561608) has the molecular formula C18H23N and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine
PubChem CID40561608
Molecular FormulaC18H23N
Molecular Weight253.39 g/mol
Exact Mass253.18
IUPAC NameN-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine
SMILESCC(C)CN[C@H](Cc1ccccc1)c1ccccc1
InChIInChI=1S/C18H23N/c1-15(2)14-19-18(17-11-7-4-8-12-17)13-16-9-5-3-6-10-16/h3-12,15,18-19H,13-14H2,1-2H3/t18-/m1/s1
InChIKeyMDCAXCVWFHKLAO-GOSISDBHSA-N
XLogP4.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1,2-diphenylethylamino)-3-methylbutan-2-ol
CID 115720401
N-(1,2-diphenylethyl)-2-methylsulfinylpropan-1-amine
CID 115896303
N-[(1S)-1,2-diphenylethyl]propan-1-amine
CID 36689865
1-[[1-(4-methylphenyl)-2-phenylethyl]amino]propan-2-ol;hydrochloride
CID 54605176
1,2-diphenyl-N-(2-propan-2-yloxyethyl)ethanamine
CID 78826333
N-(2-fluoroethyl)-1,2-diphenylethanamine
CID 113247505
(2S)-2-(2-methylpropylamino)-3-phenylpropan-1-ol
CID 102610095
N'-(1,2-diphenylethyl)ethane-1,2-diamine;dihydrochloride
CID 70443145
N-(1,2-diphenylethyl)-3-methylbut-2-en-1-amine
CID 106179833
N-[(1S)-1,2-diphenylethyl]hydroxylamine
CID 163358827
N-(1,2-diphenylethyl)hydroxylamine
CID 82685199
(1R)-2-methyl-N-(2-methylpropyl)-1-phenylpropan-1-amine
CID 93027510

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine?
The IUPAC name of N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine (CID 40561608) is N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine is CC(C)CN[C@H](Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine?
The InChIKey is MDCAXCVWFHKLAO-GOSISDBHSA-N. The full InChI is InChI=1S/C18H23N/c1-15(2)14-19-18(17-11-7-4-8-12-17)13-16-9-5-3-6-10-16/h3-12,15,18-19H,13-14H2,1-2H3/t18-/m1/s1.
What are the key properties of N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine?
N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine has a molecular weight of 253.39 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1,2-diphenylethyl]-2-methylpropan-1-amine is sourced from PubChem (CID 40561608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).