N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine

C15H24N2 — CID 116949253

IUPACN-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine
SMILESCNC(CCCN)c1ccc2c(c1)CCCC2
InChIInChI=1S/C15H24N2/c1-17-15(7-4-10-16)14-9-8-12-5-2-3-6-13(12)11-14/h8-9,11,15,17H,2-7,10,16H2,1H3
InChIKeyJPFUVLQVTWTGJZ-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.56
Rot. Bonds5

About N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine

N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine (PubChem CID 116949253) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine.

Molecular Properties

Compound NameN-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine
PubChem CID116949253
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine
SMILESCNC(CCCN)c1ccc2c(c1)CCCC2
InChIInChI=1S/C15H24N2/c1-17-15(7-4-10-16)14-9-8-12-5-2-3-6-13(12)11-14/h8-9,11,15,17H,2-7,10,16H2,1H3
InChIKeyJPFUVLQVTWTGJZ-UHFFFAOYSA-N
XLogP2.56
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-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

4-(methylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol
CID 116952908
3-cyclopentyl-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-amine
CID 43480658
4-(2,3-dihydro-1H-inden-5-yl)-4-(methylamino)butanenitrile
CID 116955267
1-(2,3-dihydro-1H-inden-5-yl)-N,2-dimethylbutane-1,4-diamine
CID 116949561
methyl 4-(methylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoate
CID 116955498
N'-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]propane-1,3-diamine
CID 60889722
N,N'-dimethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanediamine
CID 116954289
5-[4-amino-1-(methylamino)butyl]-1,3-dihydroindol-2-one
CID 116949295
1-(5,6,7,8-tetrahydronaphthalen-2-yl)propane-1,3-diamine
CID 116932733
2-cycloheptyl-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 114457518
1-(3,4-dimethoxyphenyl)-N-methylbutane-1,4-diamine
CID 116949261
N-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)hexan-1-amine
CID 43494268

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine?
The IUPAC name of N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine (CID 116949253) is N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine.
What is the SMILES notation for N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine?
The canonical SMILES for N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine is CNC(CCCN)c1ccc2c(c1)CCCC2.
What is the InChIKey of N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine?
The InChIKey is JPFUVLQVTWTGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-17-15(7-4-10-16)14-9-8-12-5-2-3-6-13(12)11-14/h8-9,11,15,17H,2-7,10,16H2,1H3.
What are the key properties of N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine?
N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butane-1,4-diamine is sourced from PubChem (CID 116949253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).