1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine

C17H21NO — CID 116721971

IUPAC1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine
SMILESCOC(C(N)Cc1cccc2ccccc12)C1CC1
InChIInChI=1S/C17H21NO/c1-19-17(13-9-10-13)16(18)11-14-7-4-6-12-5-2-3-8-15(12)14/h2-8,13,16-17H,9-11,18H2,1H3
InChIKeyOQWIEKSKFWPYBT-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.13
Rot. Bonds5

About 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine

1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine (PubChem CID 116721971) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine
PubChem CID116721971
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine
SMILESCOC(C(N)Cc1cccc2ccccc12)C1CC1
InChIInChI=1S/C17H21NO/c1-19-17(13-9-10-13)16(18)11-14-7-4-6-12-5-2-3-8-15(12)14/h2-8,13,16-17H,9-11,18H2,1H3
InChIKeyOQWIEKSKFWPYBT-UHFFFAOYSA-N
XLogP3.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-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-methoxy-1-naphthalen-1-ylbutan-2-amine
CID 79616440
3-methoxy-1-naphthalen-1-ylpentan-2-amine
CID 116715173
1-(3-methylcyclopentyl)-2-naphthalen-1-ylethanamine
CID 65413962
(1-cyclopropyl-1-ethoxy-3-naphthalen-1-ylpropan-2-yl)hydrazine
CID 105273185
1-cyclohexyl-3-(2-fluoro-3-methoxyphenyl)-1-methoxypropan-2-amine
CID 116771238
1-cyclopropyl-3-(4-ethylphenyl)-1-methoxypropan-2-amine
CID 116722006
1-methoxy-3-naphthalen-1-ylpropan-2-amine
CID 62603537
1-(4-methylcyclohexyl)-2-naphthalen-1-ylethanol
CID 63411216
2-naphthalen-1-yl-1-(thiolan-3-yl)ethanamine
CID 105131271
3-methyl-1-naphthalen-1-ylhexan-2-amine
CID 61078654
methyl (2S)-2-amino-3-naphthalen-1-ylpropanoate
CID 18714238
4-methoxy-1-naphthalen-1-ylbutan-2-amine
CID 61079778

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine?
The IUPAC name of 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine (CID 116721971) is 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine.
What is the SMILES notation for 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine?
The canonical SMILES for 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine is COC(C(N)Cc1cccc2ccccc12)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine?
The InChIKey is OQWIEKSKFWPYBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-19-17(13-9-10-13)16(18)11-14-7-4-6-12-5-2-3-8-15(12)14/h2-8,13,16-17H,9-11,18H2,1H3.
What are the key properties of 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine?
1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine has a molecular weight of 255.36 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 1-cyclopropyl-1-methoxy-3-naphthalen-1-ylpropan-2-amine is sourced from PubChem (CID 116721971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).