(2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide

C23H24N2O — CID 100856193

IUPAC(2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide
SMILESC[C@@H](C(=O)Nc1cccc2ccccc12)N1CC[C@@H](c2ccccc2)C1
InChIInChI=1S/C23H24N2O/c1-17(25-15-14-20(16-25)18-8-3-2-4-9-18)23(26)24-22-13-7-11-19-10-5-6-12-21(19)22/h2-13,17,20H,14-16H2,1H3,(H,24,26)/t17-,20+/m0/s1
InChIKeyRPHWWOWWZLDZEY-FXAWDEMLSA-N
MW344.46 g/mol
LogP4.66
Rot. Bonds4

About (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide

(2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide (PubChem CID 100856193) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide.

Molecular Properties

Compound Name(2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide
PubChem CID100856193
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC Name(2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide
SMILESC[C@@H](C(=O)Nc1cccc2ccccc12)N1CC[C@@H](c2ccccc2)C1
InChIInChI=1S/C23H24N2O/c1-17(25-15-14-20(16-25)18-8-3-2-4-9-18)23(26)24-22-13-7-11-19-10-5-6-12-21(19)22/h2-13,17,20H,14-16H2,1H3,(H,24,26)/t17-,20+/m0/s1
InChIKeyRPHWWOWWZLDZEY-FXAWDEMLSA-N
XLogP4.66
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(2-chlorophenyl)-2-[(3R)-3-phenylpyrrolidin-1-yl]propanamide
CID 95272026
(2R)-N-(2-methylsulfonylphenyl)-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide
CID 100851395
(2R)-N-(2,4-difluorophenyl)-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide
CID 100851243
N-naphthalen-1-yl-2-piperazin-1-ylpropanamide
CID 43089580
(2S)-N-[(4-methoxyphenyl)methyl]-2-[(3R)-3-phenylpyrrolidin-1-yl]propanamide
CID 95308982
(2R)-2-[4-[3-(dimethylamino)-1H-1,2,4-triazol-5-yl]piperidin-1-yl]-N-naphthalen-1-ylpropanamide
CID 124880412
(2R)-N-phenyl-2-(4-phenylpiperidin-1-yl)propanamide
CID 125483089
(2S)-N-[(2-fluorophenyl)methyl]-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide
CID 100851383
2-[4-(benzenesulfonyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide
CID 4824595
(2S)-2-[4-(2,2-difluoroethyl)piperazin-1-yl]-N-naphthalen-1-ylpropanamide
CID 94762816
ethyl 2-(3-phenylpyrrolidin-1-yl)propanoate
CID 62070395
2-methyl-3-(3-phenylpyrrolidin-1-yl)butanoic acid
CID 79406550

Frequently Asked Questions

What is the IUPAC name of (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide?
The IUPAC name of (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide (CID 100856193) is (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide.
What is the SMILES notation for (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide?
The canonical SMILES for (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide is C[C@@H](C(=O)Nc1cccc2ccccc12)N1CC[C@@H](c2ccccc2)C1.
What is the InChIKey of (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide?
The InChIKey is RPHWWOWWZLDZEY-FXAWDEMLSA-N. The full InChI is InChI=1S/C23H24N2O/c1-17(25-15-14-20(16-25)18-8-3-2-4-9-18)23(26)24-22-13-7-11-19-10-5-6-12-21(19)22/h2-13,17,20H,14-16H2,1H3,(H,24,26)/t17-,20+/m0/s1.
What are the key properties of (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide?
(2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide has a molecular weight of 344.46 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-naphthalen-1-yl-2-[(3S)-3-phenylpyrrolidin-1-yl]propanamide is sourced from PubChem (CID 100856193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).