2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide

C25H28N2O — CID 129316248

IUPAC2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide
SMILESCC1(C(=O)NCc2cccc3ccccc23)CCN1CCCc1ccccc1
InChIInChI=1S/C25H28N2O/c1-25(16-18-27(25)17-8-11-20-9-3-2-4-10-20)24(28)26-19-22-14-7-13-21-12-5-6-15-23(21)22/h2-7,9-10,12-15H,8,11,16-19H2,1H3,(H,26,28)
InChIKeyHGOLRWCTECNCDS-UHFFFAOYSA-N
MW372.51 g/mol
LogP4.55
Rot. Bonds7

About 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide

2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide (PubChem CID 129316248) has the molecular formula C25H28N2O and a molecular weight of 372.51 g/mol. Its IUPAC name is 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide
PubChem CID129316248
Molecular FormulaC25H28N2O
Molecular Weight372.51 g/mol
Exact Mass372.22
IUPAC Name2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide
SMILESCC1(C(=O)NCc2cccc3ccccc23)CCN1CCCc1ccccc1
InChIInChI=1S/C25H28N2O/c1-25(16-18-27(25)17-8-11-20-9-3-2-4-10-20)24(28)26-19-22-14-7-13-21-12-5-6-15-23(21)22/h2-7,9-10,12-15H,8,11,16-19H2,1H3,(H,26,28)
InChIKeyHGOLRWCTECNCDS-UHFFFAOYSA-N
XLogP4.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(naphthalen-1-ylmethyl)-1-(2-phenylethyl)azetidine-2-carboxamide
CID 46943675
N-benzyl-2-methyl-5-oxo-1-(3-phenylpropyl)pyrrolidine-2-carboxamide
CID 46247148
2-naphthalen-1-yl-N-(3-phenylpropyl)acetamide
CID 4807047
(3R)-N-[(2-methoxyphenyl)methyl]-3-methyl-1-oxo-2-(3-phenylpropyl)-4H-pyrazino[1,2-a]indole-3-carboxamide
CID 92740135
N-[(2-methoxyphenyl)methyl]-3-methyl-1-oxo-2-(3-phenylpropyl)-4H-pyrazino[1,2-a]indole-3-carboxamide
CID 46273213
(2R)-N-benzyl-2-methyl-1-[2-(2-methylphenyl)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 92734431
1-[[4-[(benzylamino)methyl]phenyl]methyl]-1-(3-morpholin-4-ylpropyl)-3-(naphthalen-1-ylmethyl)urea
CID 59826221
N-(4-butylphenyl)-2-naphthalen-1-ylacetamide
CID 7314094
N-(naphthalen-1-ylmethyl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-1,3-dihydroindene-2-carboxamide
CID 142778693
(2R)-N-benzyl-1-[2-(2-chlorophenyl)ethyl]-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 92734433
5-N-ethyl-3-N-(naphthalen-1-ylmethyl)-4-oxo-1-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 42368833
2-ethyl-N-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide
CID 83062780

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide?
The IUPAC name of 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide (CID 129316248) is 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide.
What is the SMILES notation for 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide?
The canonical SMILES for 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide is CC1(C(=O)NCc2cccc3ccccc23)CCN1CCCc1ccccc1.
What is the InChIKey of 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide?
The InChIKey is HGOLRWCTECNCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O/c1-25(16-18-27(25)17-8-11-20-9-3-2-4-10-20)24(28)26-19-22-14-7-13-21-12-5-6-15-23(21)22/h2-7,9-10,12-15H,8,11,16-19H2,1H3,(H,26,28).
What are the key properties of 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide?
2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide has a molecular weight of 372.51 g/mol, XLogP of 4.55, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(naphthalen-1-ylmethyl)-1-(3-phenylpropyl)azetidine-2-carboxamide is sourced from PubChem (CID 129316248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).