1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine

C16H22N2 — CID 115197005

IUPAC1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
SMILESCC(N)CN(C)CCc1ccc2ccccc2c1
InChIInChI=1S/C16H22N2/c1-13(17)12-18(2)10-9-14-7-8-15-5-3-4-6-16(15)11-14/h3-8,11,13H,9-10,12,17H2,1-2H3
InChIKeyFCZYKKFMVPDVCL-UHFFFAOYSA-N
MW242.37 g/mol
LogP2.66
Rot. Bonds5

About 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine

1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine (PubChem CID 115197005) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
PubChem CID115197005
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
SMILESCC(N)CN(C)CCc1ccc2ccccc2c1
InChIInChI=1S/C16H22N2/c1-13(17)12-18(2)10-9-14-7-8-15-5-3-4-6-16(15)11-14/h3-8,11,13H,9-10,12,17H2,1-2H3
InChIKeyFCZYKKFMVPDVCL-UHFFFAOYSA-N
XLogP2.66
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[methyl(2-naphthalen-2-ylethyl)amino]ethanethiol
CID 115224440
(2R)-4-naphthalen-2-ylbutan-2-amine
CID 131577314
2-[methyl(2-naphthalen-2-ylethyl)amino]ethanol
CID 113236296
1-N-methyl-1-N-(naphthalen-2-ylmethyl)butane-1,3-diamine
CID 115199470
2-N-methyl-2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
CID 117040198
1-N-[2-(4-butan-2-ylphenyl)ethyl]-1-N-methylpropane-1,2-diamine
CID 115196909
methyl 2-[methyl(2-naphthalen-2-ylethyl)amino]acetate
CID 115233197
N-(2-naphthalen-2-ylethyl)-N-propylpropan-1-amine
CID 11230589
2-methyl-2-[methyl(2-naphthalen-2-ylethyl)amino]propanenitrile
CID 115129759
(E)-4-[methyl(2-naphthalen-2-ylethyl)amino]but-2-enoic acid
CID 115237385
2-(3-iodobutyl)naphthalene
CID 162353144
1-N-[2-(2,4-dimethylphenyl)ethyl]-1-N-methylpropane-1,2-diamine
CID 115196905

Frequently Asked Questions

What is the IUPAC name of 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
The IUPAC name of 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine (CID 115197005) is 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine.
What is the SMILES notation for 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
The canonical SMILES for 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine is CC(N)CN(C)CCc1ccc2ccccc2c1.
What is the InChIKey of 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
The InChIKey is FCZYKKFMVPDVCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-13(17)12-18(2)10-9-14-7-8-15-5-3-4-6-16(15)11-14/h3-8,11,13H,9-10,12,17H2,1-2H3.
What are the key properties of 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine has a molecular weight of 242.37 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-methyl-1-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine is sourced from PubChem (CID 115197005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).