N-methyl-1-naphthalen-1-ylethane-1,2-diamine

C13H16N2 — CID 14340342

IUPACN-methyl-1-naphthalen-1-ylethane-1,2-diamine
SMILESCNC(CN)c1cccc2ccccc12
InChIInChI=1S/C13H16N2/c1-15-13(9-14)12-8-4-6-10-5-2-3-7-11(10)12/h2-8,13,15H,9,14H2,1H3
InChIKeySXRQVSGOLPBZOE-UHFFFAOYSA-N
MW200.28 g/mol
LogP2.06
Rot. Bonds3

About N-methyl-1-naphthalen-1-ylethane-1,2-diamine

N-methyl-1-naphthalen-1-ylethane-1,2-diamine (PubChem CID 14340342) has the molecular formula C13H16N2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-methyl-1-naphthalen-1-ylethane-1,2-diamine.

Molecular Properties

Compound NameN-methyl-1-naphthalen-1-ylethane-1,2-diamine
PubChem CID14340342
Molecular FormulaC13H16N2
Molecular Weight200.28 g/mol
Exact Mass200.13
IUPAC NameN-methyl-1-naphthalen-1-ylethane-1,2-diamine
SMILESCNC(CN)c1cccc2ccccc12
InChIInChI=1S/C13H16N2/c1-15-13(9-14)12-8-4-6-10-5-2-3-7-11(10)12/h2-8,13,15H,9,14H2,1H3
InChIKeySXRQVSGOLPBZOE-UHFFFAOYSA-N
XLogP2.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-naphthalen-1-ylethane-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

N,3-dimethyl-1-naphthalen-1-ylbutan-1-amine
CID 62716736
N-methyl-1-naphthalen-1-ylpentan-1-amine
CID 55103784
3-ethyl-N-methyl-1-naphthalen-1-ylpentan-1-amine
CID 82923409
N'-methyl-1-naphthalen-1-ylmethanediamine
CID 116939404
2-ethylsulfanyl-N-methyl-1-naphthalen-1-ylethanamine
CID 64614644
N-methyl-1-naphthalen-1-yl-2-propan-2-ylpropane-1,3-diamine
CID 116960307
cerium(3+);2-naphthalen-1-ylpropan-1-amine;trichloride;hydrate
CID 159849461
2-(4-fluorophenyl)-N-methyl-1-naphthalen-1-ylethanamine
CID 61065371
3-ethoxy-N-methyl-1-naphthalen-1-ylpropan-1-amine
CID 112688299
N,4-dimethyl-1-naphthalen-1-ylpent-4-en-1-amine
CID 114474538
(1S)-1-(2,3-dichlorophenyl)-N-methylethane-1,2-diamine
CID 94343262
1-(2-fluoro-3-methylphenyl)-N-methylethane-1,2-diamine
CID 127004323

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
The IUPAC name of N-methyl-1-naphthalen-1-ylethane-1,2-diamine (CID 14340342) is N-methyl-1-naphthalen-1-ylethane-1,2-diamine.
What is the SMILES notation for N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
The canonical SMILES for N-methyl-1-naphthalen-1-ylethane-1,2-diamine is CNC(CN)c1cccc2ccccc12.
What is the InChIKey of N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
The InChIKey is SXRQVSGOLPBZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-15-13(9-14)12-8-4-6-10-5-2-3-7-11(10)12/h2-8,13,15H,9,14H2,1H3.
What are the key properties of N-methyl-1-naphthalen-1-ylethane-1,2-diamine?
N-methyl-1-naphthalen-1-ylethane-1,2-diamine has a molecular weight of 200.28 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-naphthalen-1-ylethane-1,2-diamine is sourced from PubChem (CID 14340342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).