(2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide

C17H19NO — CID 92978612

IUPAC(2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide
SMILESC[C@H](NC(=O)[C@@H](C)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-13(15-9-5-3-6-10-15)17(19)18-14(2)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,18,19)/t13-,14-/m0/s1
InChIKeyZWNCJNODOVPNTF-KBPBESRZSA-N
MW253.35 g/mol
LogP3.67
Rot. Bonds4

About (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide

(2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide (PubChem CID 92978612) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide.

Molecular Properties

Compound Name(2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide
PubChem CID92978612
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name(2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide
SMILESC[C@H](NC(=O)[C@@H](C)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-13(15-9-5-3-6-10-15)17(19)18-14(2)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,18,19)/t13-,14-/m0/s1
InChIKeyZWNCJNODOVPNTF-KBPBESRZSA-N
XLogP3.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide?
The IUPAC name of (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide (CID 92978612) is (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide.
What is the SMILES notation for (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide?
The canonical SMILES for (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide is C[C@H](NC(=O)[C@@H](C)c1ccccc1)c1ccccc1.
What is the InChIKey of (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide?
The InChIKey is ZWNCJNODOVPNTF-KBPBESRZSA-N. The full InChI is InChI=1S/C17H19NO/c1-13(15-9-5-3-6-10-15)17(19)18-14(2)16-11-7-4-8-12-16/h3-14H,1-2H3,(H,18,19)/t13-,14-/m0/s1.
What are the key properties of (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide?
(2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide has a molecular weight of 253.35 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide is sourced from PubChem (CID 92978612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).