1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide

C17H20N2O — CID 115183467

IUPAC1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide
SMILESCc1ccc2cc(NC(=O)C3(CN)CCC3)ccc2c1
InChIInChI=1S/C17H20N2O/c1-12-3-4-14-10-15(6-5-13(14)9-12)19-16(20)17(11-18)7-2-8-17/h3-6,9-10H,2,7-8,11,18H2,1H3,(H,19,20)
InChIKeyAMLJFSXVHSJVLY-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.22
Rot. Bonds3

About 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide

1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide (PubChem CID 115183467) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide
PubChem CID115183467
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide
SMILESCc1ccc2cc(NC(=O)C3(CN)CCC3)ccc2c1
InChIInChI=1S/C17H20N2O/c1-12-3-4-14-10-15(6-5-13(14)9-12)19-16(20)17(11-18)7-2-8-17/h3-6,9-10H,2,7-8,11,18H2,1H3,(H,19,20)
InChIKeyAMLJFSXVHSJVLY-UHFFFAOYSA-N
XLogP3.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]cyclobutane-1-carboxamide
CID 80587920
1-(aminomethyl)-N-(2-bromo-5-methylphenyl)cyclobutane-1-carboxamide
CID 82756642
1-(aminomethyl)-N-(3-fluoro-4-hydroxyphenyl)cyclobutane-1-carboxamide
CID 113311717
1-(aminomethyl)-N-(3-iodo-4-methylphenyl)cyclohexane-1-carboxamide
CID 115437382
1-(aminomethyl)-N-(4-methyl-3-nitrophenyl)cyclobutane-1-carboxamide
CID 115447360
1-(aminomethyl)-N-pyridin-4-ylcyclobutane-1-carboxamide
CID 80587391
1-(aminomethyl)-N-(1-benzothiophen-5-yl)cyclopentane-1-carboxamide
CID 81489454
1-(aminomethyl)-N-(1H-indol-5-yl)cyclopentane-1-carboxamide
CID 81489854
2-amino-N-(6-methylnaphthalen-2-yl)acetamide
CID 115151559
1-(aminomethyl)-N-(3,5-dimethoxyphenyl)cyclobutane-1-carboxamide
CID 80588722
5-[[1-(aminomethyl)cyclobutanecarbonyl]amino]-2-hydroxybenzoic acid
CID 115448230
1-(aminomethyl)-N-(2-bromo-5-methylphenyl)cyclopentane-1-carboxamide
CID 82757222

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide (CID 115183467) is 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide is Cc1ccc2cc(NC(=O)C3(CN)CCC3)ccc2c1.
What is the InChIKey of 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide?
The InChIKey is AMLJFSXVHSJVLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-3-4-14-10-15(6-5-13(14)9-12)19-16(20)17(11-18)7-2-8-17/h3-6,9-10H,2,7-8,11,18H2,1H3,(H,19,20).
What are the key properties of 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide?
1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide has a molecular weight of 268.36 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(6-methylnaphthalen-2-yl)cyclobutane-1-carboxamide is sourced from PubChem (CID 115183467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).