(2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide

C15H22N2O — CID 78954609

IUPAC(2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide
SMILESCCN(CC1CC1)C(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C15H22N2O/c1-2-17(11-13-8-9-13)15(18)14(16)10-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,16H2,1H3/t14-/m1/s1
InChIKeyNFZUGOWPLCVYAF-CQSZACIVSA-N
MW246.35 g/mol
LogP1.81
Rot. Bonds6

About (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide

(2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide (PubChem CID 78954609) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide
PubChem CID78954609
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name(2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide
SMILESCCN(CC1CC1)C(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C15H22N2O/c1-2-17(11-13-8-9-13)15(18)14(16)10-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,16H2,1H3/t14-/m1/s1
InChIKeyNFZUGOWPLCVYAF-CQSZACIVSA-N
XLogP1.81
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
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

2-amino-N-ethyl-3-phenyl-N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]propanamide
CID 119891449
(2S)-2-amino-N-(cyclobutylmethyl)-N-ethyl-4-phenylbutanamide
CID 107398372
(2S)-2-amino-N-ethyl-N-(2-methylpropyl)-3-phenylpropanamide
CID 55150348
(2S)-2-amino-N-ethyl-3-phenyl-N-propylpropanamide;hydrochloride
CID 119280650
2-amino-N-ethyl-N-(2-methylpropyl)-3-phenylpropanamide
CID 43273815
2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]-(cyclopropylmethyl)amino]acetic acid
CID 76894221
2-amino-N-ethyl-3-(4-hydroxyphenyl)-N-(oxolan-3-ylmethyl)propanamide
CID 76894991
2-amino-N-(cyclobutylmethyl)-N-ethyl-2-phenylacetamide
CID 107398345
2-amino-3-phenyl-N,N-dipropylpropanamide;hydrochloride
CID 56831878
2-amino-N-methyl-N-(oxan-4-ylmethyl)-3-phenylpropanamide
CID 53409102
(2S)-2-amino-N-ethyl-N-(oxolan-3-ylmethyl)-4-phenylbutanamide
CID 104984084
2-amino-N-cyclohexyl-N-ethyl-3-phenylpropanamide;hydrochloride
CID 56831881

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide (CID 78954609) is (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide is CCN(CC1CC1)C(=O)[C@H](N)Cc1ccccc1.
What is the InChIKey of (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide?
The InChIKey is NFZUGOWPLCVYAF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-17(11-13-8-9-13)15(18)14(16)10-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,16H2,1H3/t14-/m1/s1.
What are the key properties of (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide?
(2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide has a molecular weight of 246.35 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(cyclopropylmethyl)-N-ethyl-3-phenylpropanamide is sourced from PubChem (CID 78954609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).