3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine

C16H21NO — CID 170865305

IUPAC3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine
SMILESCOc1ccc2ccccc2c1CCCN(C)C
InChIInChI=1S/C16H21NO/c1-17(2)12-6-9-15-14-8-5-4-7-13(14)10-11-16(15)18-3/h4-5,7-8,10-11H,6,9,12H2,1-3H3
InChIKeyLIMUQQAFBBYRPR-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.34
Rot. Bonds5

About 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine

3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine (PubChem CID 170865305) has the molecular formula C16H21NO and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine
PubChem CID170865305
Molecular FormulaC16H21NO
Molecular Weight243.35 g/mol
Exact Mass243.16
IUPAC Name3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine
SMILESCOc1ccc2ccccc2c1CCCN(C)C
InChIInChI=1S/C16H21NO/c1-17(2)12-6-9-15-14-8-5-4-7-13(14)10-11-16(15)18-3/h4-5,7-8,10-11H,6,9,12H2,1-3H3
InChIKeyLIMUQQAFBBYRPR-UHFFFAOYSA-N
XLogP3.34
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine 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-[(2-methoxynaphthalen-1-yl)methyl]-N-methyl-2-phenylethanamine
CID 3299087
2-[3-(dimethylamino)propyl]-3,6-dimethoxyaniline
CID 170865977
N'-[(2-methoxynaphthalen-1-yl)methyl]-N'-methylethane-1,2-diamine
CID 62682753
N,N-bis[(2-methoxynaphthalen-1-yl)methyl]butan-1-amine
CID 53235294
N,N-dimethyl-3-(10-methylanthracen-9-yl)propan-1-amine
CID 170865143
4-(2-methoxynaphthalen-1-yl)butane-1,2-diol
CID 82185801
N,N-dimethyl-3-phenanthren-3-ylpropan-1-amine
CID 170865620
N-[2-(2-methoxynaphthalen-1-yl)ethyl]-2-methylpropan-1-amine
CID 64867903
2-[3-(dimethylamino)propyl]naphthalen-1-amine
CID 19734899
(2R)-1-(2-methoxynaphthalen-1-yl)propan-2-ol
CID 92532795
(2S)-1-methoxy-N-[2-(2-methoxynaphthalen-1-yl)ethyl]propan-2-amine
CID 95127622
2-methoxy-1,6-bis[(2-methoxynaphthalen-1-yl)methyl]naphthalene
CID 139095345

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine (CID 170865305) is 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine is COc1ccc2ccccc2c1CCCN(C)C.
What is the InChIKey of 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine?
The InChIKey is LIMUQQAFBBYRPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO/c1-17(2)12-6-9-15-14-8-5-4-7-13(14)10-11-16(15)18-3/h4-5,7-8,10-11H,6,9,12H2,1-3H3.
What are the key properties of 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine?
3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine has a molecular weight of 243.35 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxynaphthalen-1-yl)-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 170865305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).