N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine

C18H24N2 — CID 115245749

IUPACN-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine
SMILESCc1ccc2cc(N(C)CC3(CN)CCC3)ccc2c1
InChIInChI=1S/C18H24N2/c1-14-4-5-16-11-17(7-6-15(16)10-14)20(2)13-18(12-19)8-3-9-18/h4-7,10-11H,3,8-9,12-13,19H2,1-2H3
InChIKeyKUNBGERZSFTMIK-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.71
Rot. Bonds4

About N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine

N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine (PubChem CID 115245749) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine
PubChem CID115245749
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine
SMILESCc1ccc2cc(N(C)CC3(CN)CCC3)ccc2c1
InChIInChI=1S/C18H24N2/c1-14-4-5-16-11-17(7-6-15(16)10-14)20(2)13-18(12-19)8-3-9-18/h4-7,10-11H,3,8-9,12-13,19H2,1-2H3
InChIKeyKUNBGERZSFTMIK-UHFFFAOYSA-N
XLogP3.71
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine
CID 115245752
N-[[1-(aminomethyl)cyclopentyl]methyl]-N,4-dimethylaniline
CID 62259755
N-[[1-(aminomethyl)cyclopropyl]methyl]-N,4-dimethylaniline
CID 84778072
N-[[1-(aminomethyl)cyclohexyl]methyl]-4-methoxy-N-methylaniline
CID 62261141
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 115245672
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylaniline
CID 115448798
5-[[1-(aminomethyl)cyclobutyl]methyl-methylamino]-1,3-dihydrobenzimidazol-2-one
CID 115245729
N-[[1-(aminomethyl)cyclopentyl]methyl]-N-ethyl-4-methylaniline
CID 62260420
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
1-(aminomethyl)-N-methyl-N-(6-methylnaphthalen-2-yl)cyclopropane-1-carboxamide
CID 115182653
N-[[1-(aminomethyl)cyclopropyl]methyl]-4-tert-butyl-N-methylaniline
CID 115243941

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine (CID 115245749) is N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine is Cc1ccc2cc(N(C)CC3(CN)CCC3)ccc2c1.
What is the InChIKey of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine?
The InChIKey is KUNBGERZSFTMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-14-4-5-16-11-17(7-6-15(16)10-14)20(2)13-18(12-19)8-3-9-18/h4-7,10-11H,3,8-9,12-13,19H2,1-2H3.
What are the key properties of N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine?
N-[[1-(aminomethyl)cyclobutyl]methyl]-N,6-dimethylnaphthalen-2-amine has a molecular weight of 268.40 g/mol, XLogP of 3.71, 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,6-dimethylnaphthalen-2-amine is sourced from PubChem (CID 115245749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).