N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine

C17H22N2 — CID 115245752

IUPACN-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine
SMILESCN(CC1(CN)CCC1)c1ccc2ccccc2c1
InChIInChI=1S/C17H22N2/c1-19(13-17(12-18)9-4-10-17)16-8-7-14-5-2-3-6-15(14)11-16/h2-3,5-8,11H,4,9-10,12-13,18H2,1H3
InChIKeyWJHUUFHATIWXJC-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.40
Rot. Bonds4

About N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine

N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine (PubChem CID 115245752) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine
PubChem CID115245752
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine
SMILESCN(CC1(CN)CCC1)c1ccc2ccccc2c1
InChIInChI=1S/C17H22N2/c1-19(13-17(12-18)9-4-10-17)16-8-7-14-5-2-3-6-15(14)11-16/h2-3,5-8,11H,4,9-10,12-13,18H2,1H3
InChIKeyWJHUUFHATIWXJC-UHFFFAOYSA-N
XLogP3.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine
CID 115245749
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylaniline
CID 115448798
N-[[1-(aminomethyl)cyclohexyl]methyl]-4-methoxy-N-methylaniline
CID 62261141
N-[[1-(aminomethyl)cyclopentyl]methyl]-N,4-dimethylaniline
CID 62259755
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 115245672
5-[[1-(aminomethyl)cyclobutyl]methyl-methylamino]-1,3-dihydrobenzimidazol-2-one
CID 115245729
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-1H-pyrrol-3-amine
CID 115245714
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-amine
CID 115243960
N-[[1-(aminomethyl)cyclopropyl]methyl]-3-chloro-N-methylaniline
CID 84789895
N-[[1-(aminomethyl)cyclopropyl]methyl]-N,4-dimethylaniline
CID 84778072
N-[[1-(aminomethyl)cyclopropyl]methyl]-4-tert-butyl-N-methylaniline
CID 115243941
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-1-phenylmethanamine
CID 82171579

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine (CID 115245752) is N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine is CN(CC1(CN)CCC1)c1ccc2ccccc2c1.
What is the InChIKey of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine?
The InChIKey is WJHUUFHATIWXJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-19(13-17(12-18)9-4-10-17)16-8-7-14-5-2-3-6-15(14)11-16/h2-3,5-8,11H,4,9-10,12-13,18H2,1H3.
What are the key properties of N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine?
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine has a molecular weight of 254.38 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine is sourced from PubChem (CID 115245752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).