2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide

C22H24N2O — CID 9131594

IUPAC2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide
SMILESCC(C)[C@H](NCC(=O)Nc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C22H24N2O/c1-16(2)22(18-10-4-3-5-11-18)23-15-21(25)24-20-14-8-12-17-9-6-7-13-19(17)20/h3-14,16,22-23H,15H2,1-2H3,(H,24,25)/t22-/m0/s1
InChIKeyAHHODVLIPNJCAC-QFIPXVFZSA-N
MW332.45 g/mol
LogP4.77
Rot. Bonds6

About 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide

2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide (PubChem CID 9131594) has the molecular formula C22H24N2O and a molecular weight of 332.45 g/mol. Its IUPAC name is 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide
PubChem CID9131594
Molecular FormulaC22H24N2O
Molecular Weight332.45 g/mol
Exact Mass332.19
IUPAC Name2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide
SMILESCC(C)[C@H](NCC(=O)Nc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C22H24N2O/c1-16(2)22(18-10-4-3-5-11-18)23-15-21(25)24-20-14-8-12-17-9-6-7-13-19(17)20/h3-14,16,22-23H,15H2,1-2H3,(H,24,25)/t22-/m0/s1
InChIKeyAHHODVLIPNJCAC-QFIPXVFZSA-N
XLogP4.77
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dichlorophenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131743
N-(9,10-dioxoanthracen-1-yl)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131839
2-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]-N-naphthalen-1-ylacetamide
CID 86786954
2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-naphthalen-1-ylacetamide
CID 8695978
N-(3-acetamidophenyl)-2-[(2-methyl-1-phenylpropyl)amino]acetamide
CID 86909136
N-(2,6-diethylphenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131674
N-[2,6-di(propan-2-yl)phenyl]-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131955
2-[[(1S)-1-(furan-2-yl)ethyl]amino]-N-naphthalen-1-ylacetamide
CID 8918107
N-(4-acetamidophenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131833
N-(2-chloro-4-methylphenyl)-2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131471
2-[[(1R)-2-methyl-1-phenylpropyl]amino]-N-[(1R)-1-phenylethyl]acetamide
CID 9131711
2-[[1-(4-chlorophenyl)-2-methylpropyl]amino]-N-(2-fluorophenyl)acetamide
CID 16598681

Frequently Asked Questions

What is the IUPAC name of 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide (CID 9131594) is 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide is CC(C)[C@H](NCC(=O)Nc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide?
The InChIKey is AHHODVLIPNJCAC-QFIPXVFZSA-N. The full InChI is InChI=1S/C22H24N2O/c1-16(2)22(18-10-4-3-5-11-18)23-15-21(25)24-20-14-8-12-17-9-6-7-13-19(17)20/h3-14,16,22-23H,15H2,1-2H3,(H,24,25)/t22-/m0/s1.
What are the key properties of 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide?
2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide has a molecular weight of 332.45 g/mol, XLogP of 4.77, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 9131594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).