N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine

C16H20N2 — CID 115214015

IUPACN-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine
SMILESCN(CC1CC(N)C1)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2/c1-18(11-12-8-15(17)9-12)16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,12,15H,8-9,11,17H2,1H3
InChIKeyNUTIIGGUAOBILB-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.01
Rot. Bonds3

About N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine

N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine (PubChem CID 115214015) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine
PubChem CID115214015
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine
SMILESCN(CC1CC(N)C1)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2/c1-18(11-12-8-15(17)9-12)16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,12,15H,8-9,11,17H2,1H3
InChIKeyNUTIIGGUAOBILB-UHFFFAOYSA-N
XLogP3.01
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-aminocyclobutyl)methyl]-N,3,4-trimethylaniline
CID 115213894
(3S)-3-[[methyl(naphthalen-2-yl)amino]methyl]-2,3-dihydro-1H-pyrrol-5-amine
CID 141317316
N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-1-amine
CID 115214014
N-[(3-aminocyclobutyl)methyl]-4-tert-butyl-N-methylaniline
CID 115213893
N-[(3-aminocyclopentyl)methyl]-N-methylaniline
CID 66008204
N-methyl-N-oxidonaphthalen-2-amine
CID 163543073
1-N-methyl-1-N-naphthalen-2-ylbutane-1,3-diamine
CID 115199230
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methylnaphthalen-2-amine
CID 115245752
N-(azetidin-3-ylmethyl)-6-methoxy-N-methylnaphthalen-2-amine
CID 115207468
N-[(3-aminocyclobutyl)methyl]-N,2,4,5-tetramethylaniline
CID 115213957
N-[(3-aminocyclobutyl)methyl]-N-methyl-1H-pyrrol-2-amine
CID 115213951
N-[(3-aminocyclobutyl)methyl]-N,2,5-trimethylaniline
CID 115213895

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine?
The IUPAC name of N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine (CID 115214015) is N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine.
What is the SMILES notation for N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine?
The canonical SMILES for N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine is CN(CC1CC(N)C1)c1ccc2ccccc2c1.
What is the InChIKey of N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine?
The InChIKey is NUTIIGGUAOBILB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-18(11-12-8-15(17)9-12)16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,12,15H,8-9,11,17H2,1H3.
What are the key properties of N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine?
N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine has a molecular weight of 240.35 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclobutyl)methyl]-N-methylnaphthalen-2-amine is sourced from PubChem (CID 115214015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).