2-[3-(dimethylamino)propyl]naphthalen-1-amine

C15H20N2 — CID 19734899

IUPAC2-[3-(dimethylamino)propyl]naphthalen-1-amine
SMILESCN(C)CCCc1ccc2ccccc2c1N
InChIInChI=1S/C15H20N2/c1-17(2)11-5-7-13-10-9-12-6-3-4-8-14(12)15(13)16/h3-4,6,8-10H,5,7,11,16H2,1-2H3
InChIKeyQJWFSQBDTOVNCY-UHFFFAOYSA-N
MW228.34 g/mol
LogP2.92
Rot. Bonds4

About 2-[3-(dimethylamino)propyl]naphthalen-1-amine

2-[3-(dimethylamino)propyl]naphthalen-1-amine (PubChem CID 19734899) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[3-(dimethylamino)propyl]naphthalen-1-amine.

Molecular Properties

Compound Name2-[3-(dimethylamino)propyl]naphthalen-1-amine
PubChem CID19734899
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2-[3-(dimethylamino)propyl]naphthalen-1-amine
SMILESCN(C)CCCc1ccc2ccccc2c1N
InChIInChI=1S/C15H20N2/c1-17(2)11-5-7-13-10-9-12-6-3-4-8-14(12)15(13)16/h3-4,6,8-10H,5,7,11,16H2,1-2H3
InChIKeyQJWFSQBDTOVNCY-UHFFFAOYSA-N
XLogP2.92
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-hexadecylnaphthalen-1-amine
CID 57354886
N,N-dimethyl-3-phenanthren-9-ylpropan-1-amine
CID 170865144
N,N-dimethyl-3-(4-methylnaphthalen-1-yl)propan-1-amine
CID 170865366
N,N-dimethyl-16-naphthalen-1-ylhexadecan-1-amine;hydrochloride
CID 174059419
N,N-dimethyl-3-phenanthren-3-ylpropan-1-amine
CID 170865620
2-[2-[4-(dimethylamino)butyl]naphthalen-1-yl]-3-methylbutanamide
CID 21127174
3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine
CID 170865305
N,N-dimethyl-3-(10-methylanthracen-9-yl)propan-1-amine
CID 170865143
3-[3-(dimethylamino)propyl]-N,N-dimethylquinolin-2-amine
CID 170866839
2-[3-[3-(dimethylamino)propyl]indol-1-yl]ethanol
CID 170866980
2-[1-[2-(dimethylamino)ethyl]naphthalen-2-yl]acetonitrile
CID 23618057
5-(dimethylamino)-1-naphthalen-1-ylpentan-2-ol
CID 70057285

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)propyl]naphthalen-1-amine?
The IUPAC name of 2-[3-(dimethylamino)propyl]naphthalen-1-amine (CID 19734899) is 2-[3-(dimethylamino)propyl]naphthalen-1-amine.
What is the SMILES notation for 2-[3-(dimethylamino)propyl]naphthalen-1-amine?
The canonical SMILES for 2-[3-(dimethylamino)propyl]naphthalen-1-amine is CN(C)CCCc1ccc2ccccc2c1N.
What is the InChIKey of 2-[3-(dimethylamino)propyl]naphthalen-1-amine?
The InChIKey is QJWFSQBDTOVNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-17(2)11-5-7-13-10-9-12-6-3-4-8-14(12)15(13)16/h3-4,6,8-10H,5,7,11,16H2,1-2H3.
What are the key properties of 2-[3-(dimethylamino)propyl]naphthalen-1-amine?
2-[3-(dimethylamino)propyl]naphthalen-1-amine has a molecular weight of 228.34 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)propyl]naphthalen-1-amine is sourced from PubChem (CID 19734899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).