3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide

C17H20N2O — CID 115161636

IUPAC3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide
SMILESCN(Cc1cccc2ccccc12)C(=O)C1CC(N)C1
InChIInChI=1S/C17H20N2O/c1-19(17(20)14-9-15(18)10-14)11-13-7-4-6-12-5-2-3-8-16(12)13/h2-8,14-15H,9-11,18H2,1H3
InChIKeyMCJSZIMLDKVJGZ-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.54
Rot. Bonds3

About 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide

3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide (PubChem CID 115161636) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide
PubChem CID115161636
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide
SMILESCN(Cc1cccc2ccccc12)C(=O)C1CC(N)C1
InChIInChI=1S/C17H20N2O/c1-19(17(20)14-9-15(18)10-14)11-13-7-4-6-12-5-2-3-8-16(12)13/h2-8,14-15H,9-11,18H2,1H3
InChIKeyMCJSZIMLDKVJGZ-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-amino-N-methyl-N-(naphthalen-1-ylmethyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120985296
N-methyl-N-(naphthalen-1-ylmethyl)pyrrolidine-3-carboxamide
CID 115159561
3-amino-N-methyl-N-(naphthalen-1-ylmethyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 119707661
3-amino-N-methyl-N-[(2,4,5-trimethylphenyl)methyl]cyclobutane-1-carboxamide
CID 115161611
N-methyl-N-(naphthalen-1-ylmethyl)carbamoyl bromide
CID 115193849
3-amino-N-methyl-N-[(3-methylphenyl)methyl]cyclobutane-1-carboxamide
CID 115161620
cis-(1S,3R)-3-amino-N-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]cyclopentane-1-carboxamide
CID 77091258
3-amino-N-methyl-N-(2-phenylethyl)cyclobutane-1-carboxamide
CID 115161711
cis-(1R,3S)-3-amino-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclohexane-1-carboxamide
CID 124685790
(1S,3S,4S)-3-amino-4-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 155940113
3-amino-N-[(2-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119738433
2-cyano-N-methyl-N-(naphthalen-1-ylmethyl)acetamide
CID 115173236

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide?
The IUPAC name of 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide (CID 115161636) is 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide?
The canonical SMILES for 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide is CN(Cc1cccc2ccccc12)C(=O)C1CC(N)C1.
What is the InChIKey of 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide?
The InChIKey is MCJSZIMLDKVJGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-19(17(20)14-9-15(18)10-14)11-13-7-4-6-12-5-2-3-8-16(12)13/h2-8,14-15H,9-11,18H2,1H3.
What are the key properties of 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide?
3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide has a molecular weight of 268.36 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-(naphthalen-1-ylmethyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 115161636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).