4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine

C19H25NO — CID 115506243

IUPAC4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine
SMILESCNC(CCC1CC1)Cc1cccc2ccc(OC)cc12
InChIInChI=1S/C19H25NO/c1-20-17(10-8-14-6-7-14)12-16-5-3-4-15-9-11-18(21-2)13-19(15)16/h3-5,9,11,13-14,17,20H,6-8,10,12H2,1-2H3
InChIKeyONXBGDBGGFNWCE-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.17
Rot. Bonds7

About 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine

4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine (PubChem CID 115506243) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine
PubChem CID115506243
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine
SMILESCNC(CCC1CC1)Cc1cccc2ccc(OC)cc12
InChIInChI=1S/C19H25NO/c1-20-17(10-8-14-6-7-14)12-16-5-3-4-15-9-11-18(21-2)13-19(15)16/h3-5,9,11,13-14,17,20H,6-8,10,12H2,1-2H3
InChIKeyONXBGDBGGFNWCE-UHFFFAOYSA-N
XLogP4.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-3-(7-methoxynaphthalen-1-yl)-N-methylpropan-2-amine
CID 115506270
1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine
CID 115506198
1-cyclopropyl-3-(7-methoxynaphthalen-1-yl)propan-2-one
CID 113325067
[5-methoxy-1-(7-methoxynaphthalen-1-yl)pentan-2-yl]hydrazine
CID 105260335
3-cyclopropyl-2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]propanoic acid
CID 120535790
[1-(7-methoxynaphthalen-1-yl)-3,3-dimethylbutan-2-yl]hydrazine
CID 105260340
2-(7-methoxynaphthalen-1-yl)-N-methylethanamine
CID 10104723
1-(7-methoxynaphthalen-1-yl)-6-methylheptan-2-ol
CID 83148133
4-cyclopentyl-1-(2,3-dichlorophenyl)-N-methylbutan-2-amine
CID 107312312
3-[(7-methoxynaphthalen-1-yl)methyl]pyrrolidine
CID 19096229
1-(7-methoxynaphthalen-1-yl)-3-phenylpropan-2-ol
CID 115506158
1-(7-methoxynaphthalen-1-yl)-3-methylbut-3-en-2-amine
CID 115506222

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine?
The IUPAC name of 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine (CID 115506243) is 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine.
What is the SMILES notation for 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine?
The canonical SMILES for 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine is CNC(CCC1CC1)Cc1cccc2ccc(OC)cc12.
What is the InChIKey of 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine?
The InChIKey is ONXBGDBGGFNWCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-20-17(10-8-14-6-7-14)12-16-5-3-4-15-9-11-18(21-2)13-19(15)16/h3-5,9,11,13-14,17,20H,6-8,10,12H2,1-2H3.
What are the key properties of 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine?
4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 4.17, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-1-(7-methoxynaphthalen-1-yl)-N-methylbutan-2-amine is sourced from PubChem (CID 115506243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).