(2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide

C15H22N2O — CID 78985501

IUPAC(2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide
SMILESCC(C1CC1)N(C)C(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C15H22N2O/c1-11(13-8-9-13)17(2)15(18)14(16)10-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10,16H2,1-2H3/t11?,14-/m1/s1
InChIKeyCYGMJMHTTYCMAI-SBXXRYSUSA-N
MW246.35 g/mol
LogP1.81
Rot. Bonds5

About (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide

(2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide (PubChem CID 78985501) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide
PubChem CID78985501
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name(2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide
SMILESCC(C1CC1)N(C)C(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C15H22N2O/c1-11(13-8-9-13)17(2)15(18)14(16)10-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10,16H2,1-2H3/t11?,14-/m1/s1
InChIKeyCYGMJMHTTYCMAI-SBXXRYSUSA-N
XLogP1.81
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopropylethyl)-N-methyl-3-phenyl-2-sulfanylpropanamide
CID 107023150
(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]-methylamino]-3-methylbutanoic acid
CID 86751008
(2R)-2-amino-N-(3,3-dimethylbutan-2-yl)-N-methyl-3-phenylpropanamide
CID 78985588
(2R)-2-amino-N-methyl-N-(4-methylpentan-2-yl)-3-phenylpropanamide
CID 78985610
(2S)-2-amino-N-(1-cyclopropylethyl)-N-methylpentanamide
CID 107568254
(2S)-2-amino-N-methyl-3-phenyl-N-(1-propan-2-ylpiperidin-4-yl)propanamide;dihydrochloride
CID 119842325
(2S)-2-amino-N-ethyl-N-methyl-3-phenylpropanamide;hydrochloride
CID 119314932
(2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide
CID 78954609
methyl (2S)-2-[[(2S)-2-[[(2R)-2-amino-3-phenylpropanoyl]-methylamino]-3-methylbutanoyl]amino]propanoate
CID 175796372
2-amino-N-methyl-N-(oxan-4-ylmethyl)-3-phenylpropanamide
CID 53409102
(2S)-2-amino-N-(dicyclopropylmethyl)-3-phenylpropanamide
CID 61248190
2-amino-N-methyl-3-phenyl-N-propylpropanamide
CID 43271352

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide (CID 78985501) is (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide is CC(C1CC1)N(C)C(=O)[C@H](N)Cc1ccccc1.
What is the InChIKey of (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide?
The InChIKey is CYGMJMHTTYCMAI-SBXXRYSUSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11(13-8-9-13)17(2)15(18)14(16)10-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10,16H2,1-2H3/t11?,14-/m1/s1.
What are the key properties of (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide?
(2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide has a molecular weight of 246.35 g/mol, XLogP of 1.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(1-cyclopropylethyl)-N-methyl-3-phenylpropanamide is sourced from PubChem (CID 78985501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).