3-(7-ethoxynaphthalen-1-yl)propan-1-amine

C15H19NO — CID 19085994

IUPAC3-(7-ethoxynaphthalen-1-yl)propan-1-amine
SMILESCCOc1ccc2cccc(CCCN)c2c1
InChIInChI=1S/C15H19NO/c1-2-17-14-9-8-13-6-3-5-12(7-4-10-16)15(13)11-14/h3,5-6,8-9,11H,2,4,7,10,16H2,1H3
InChIKeyKOBCQXJSUDWLRJ-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.13
Rot. Bonds5

About 3-(7-ethoxynaphthalen-1-yl)propan-1-amine

3-(7-ethoxynaphthalen-1-yl)propan-1-amine (PubChem CID 19085994) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 3-(7-ethoxynaphthalen-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(7-ethoxynaphthalen-1-yl)propan-1-amine
PubChem CID19085994
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name3-(7-ethoxynaphthalen-1-yl)propan-1-amine
SMILESCCOc1ccc2cccc(CCCN)c2c1
InChIInChI=1S/C15H19NO/c1-2-17-14-9-8-13-6-3-5-12(7-4-10-16)15(13)11-14/h3,5-6,8-9,11H,2,4,7,10,16H2,1H3
InChIKeyKOBCQXJSUDWLRJ-UHFFFAOYSA-N
XLogP3.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(7-ethoxynaphthalen-1-yl)propan-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

3-(7-propylnaphthalen-1-yl)propan-1-amine
CID 19086002
3-(2-chloro-7-ethoxyquinolin-3-yl)propan-1-amine
CID 170868054
1,7-diethoxynaphthalene
CID 13359547
2-ethoxynaphthalene
CID 118978197
2-(6-ethoxynaphthalen-2-yl)ethanamine
CID 170888283
3-(4-ethoxynaphthalen-1-yl)propan-1-amine
CID 82263179
7-ethoxynaphthalene-1-carbaldehyde
CID 123261144
5-(7-methoxynaphthalen-1-yl)pentanamide
CID 67627444
2-(7-butoxynaphthalen-1-yl)acetic acid
CID 19085996
1-(2-azidoethyl)-7-propoxynaphthalene
CID 141289439
3-(6-ethoxy-1,3-benzothiazol-2-yl)propan-1-amine
CID 39106663
2-(7-pentoxynaphthalen-1-yl)acetic acid
CID 19086042

Frequently Asked Questions

What is the IUPAC name of 3-(7-ethoxynaphthalen-1-yl)propan-1-amine?
The IUPAC name of 3-(7-ethoxynaphthalen-1-yl)propan-1-amine (CID 19085994) is 3-(7-ethoxynaphthalen-1-yl)propan-1-amine.
What is the SMILES notation for 3-(7-ethoxynaphthalen-1-yl)propan-1-amine?
The canonical SMILES for 3-(7-ethoxynaphthalen-1-yl)propan-1-amine is CCOc1ccc2cccc(CCCN)c2c1.
What is the InChIKey of 3-(7-ethoxynaphthalen-1-yl)propan-1-amine?
The InChIKey is KOBCQXJSUDWLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-2-17-14-9-8-13-6-3-5-12(7-4-10-16)15(13)11-14/h3,5-6,8-9,11H,2,4,7,10,16H2,1H3.
What are the key properties of 3-(7-ethoxynaphthalen-1-yl)propan-1-amine?
3-(7-ethoxynaphthalen-1-yl)propan-1-amine has a molecular weight of 229.32 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-ethoxynaphthalen-1-yl)propan-1-amine is sourced from PubChem (CID 19085994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).