2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine

C16H22N2 — CID 116938972

IUPAC2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine
SMILESCNC(C)(C)C(N)c1ccc2cc(C)ccc2c1
InChIInChI=1S/C16H22N2/c1-11-5-6-13-10-14(8-7-12(13)9-11)15(17)16(2,3)18-4/h5-10,15,18H,17H2,1-4H3
InChIKeyIXPOXDCRXLJVDB-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.15
Rot. Bonds3

About 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine

2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine (PubChem CID 116938972) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine
PubChem CID116938972
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine
SMILESCNC(C)(C)C(N)c1ccc2cc(C)ccc2c1
InChIInChI=1S/C16H22N2/c1-11-5-6-13-10-14(8-7-12(13)9-11)15(17)16(2,3)18-4/h5-10,15,18H,17H2,1-4H3
InChIKeyIXPOXDCRXLJVDB-UHFFFAOYSA-N
XLogP3.15
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2,2-dimethyl-3-(6-methylnaphthalen-2-yl)propanoic acid
CID 116937993
3-amino-2,2-dimethyl-3-(6-methylnaphthalen-2-yl)propanenitrile
CID 116940475
1-(3-chloro-4-fluorophenyl)-2-N,2-dimethylpropane-1,2-diamine
CID 116938921
(2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol
CID 66808040
N-methyl-1-(6-methylnaphthalen-2-yl)-1-piperazin-1-ylmethanamine
CID 116954863
1-(6-methylnaphthalen-2-yl)ethanethiol
CID 116866764
1-chloro-N,N-dimethyl-1-(6-methylnaphthalen-2-yl)methanamine
CID 116915298
methyl 2-hydroxy-2-(6-methylnaphthalen-2-yl)acetate
CID 70589990
6-[1-amino-2-methyl-2-(methylamino)propyl]-3H-1,3-benzoxazol-2-one
CID 116938938
2-ethyl-N-methyl-1-(6-methylnaphthalen-2-yl)propane-1,3-diamine
CID 116960090
3-[amino-(6-methylnaphthalen-2-yl)methyl]cyclobutan-1-amine
CID 116937429
2-[amino-(6-methylnaphthalen-2-yl)methyl]-3-methylbutan-1-ol
CID 116945692

Frequently Asked Questions

What is the IUPAC name of 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine?
The IUPAC name of 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine (CID 116938972) is 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine.
What is the SMILES notation for 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine?
The canonical SMILES for 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine is CNC(C)(C)C(N)c1ccc2cc(C)ccc2c1.
What is the InChIKey of 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine?
The InChIKey is IXPOXDCRXLJVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-11-5-6-13-10-14(8-7-12(13)9-11)15(17)16(2,3)18-4/h5-10,15,18H,17H2,1-4H3.
What are the key properties of 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine?
2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine has a molecular weight of 242.37 g/mol, XLogP of 3.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-dimethyl-1-(6-methylnaphthalen-2-yl)propane-1,2-diamine is sourced from PubChem (CID 116938972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).