ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine

C23H30N2O — CID 145081075

IUPACethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine
SMILESCC.CCC(CCNc1cccc2cccnc12)c1ccccc1OC
InChIInChI=1S/C21H24N2O.C2H6/c1-3-16(18-10-4-5-12-20(18)24-2)13-15-22-19-11-6-8-17-9-7-14-23-21(17)19;1-2/h4-12,14,16,22H,3,13,15H2,1-2H3;1-2H3
InChIKeyJFOHQOHUFAUTQO-UHFFFAOYSA-N
MW350.51 g/mol
LogP6.27
Rot. Bonds7

About ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine

ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine (PubChem CID 145081075) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine.

Molecular Properties

Compound Nameethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine
PubChem CID145081075
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Nameethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine
SMILESCC.CCC(CCNc1cccc2cccnc12)c1ccccc1OC
InChIInChI=1S/C21H24N2O.C2H6/c1-3-16(18-10-4-5-12-20(18)24-2)13-15-22-19-11-6-8-17-9-7-14-23-21(17)19;1-2/h4-12,14,16,22H,3,13,15H2,1-2H3;1-2H3
InChIKeyJFOHQOHUFAUTQO-UHFFFAOYSA-N
XLogP6.27
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.51
LogP ≤ 56.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-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-(3-methoxy-3-methylbutyl)quinolin-8-amine
CID 106675039
N-heptylquinolin-8-amine
CID 43130175
N-(3,3-dimethylbutyl)quinolin-8-amine
CID 62965994
1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(quinolin-8-ylamino)propan-1-one
CID 109029505
2-ethoxy-N-(quinolin-8-ylmethyl)aniline
CID 28612848
N-methoxyquinolin-8-amine
CID 143696561
N-(2-methoxy-5-methylphenyl)-3-(quinolin-8-ylamino)propanamide
CID 109040020
(1S)-1-(2-quinolin-8-yloxyphenyl)propan-1-amine
CID 103959274
2-methyl-5-(quinolin-8-ylamino)pentan-2-ol
CID 118731137
2-methoxy-N-[3-oxo-3-(quinolin-8-ylamino)propyl]benzamide
CID 38266767
3-ethoxy-4-methoxy-N-quinolin-8-ylbenzamide
CID 26123353
N-[1-(4-methoxyphenyl)ethyl]quinolin-8-amine
CID 43191660

Frequently Asked Questions

What is the IUPAC name of ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine?
The IUPAC name of ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine (CID 145081075) is ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine.
What is the SMILES notation for ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine?
The canonical SMILES for ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine is CC.CCC(CCNc1cccc2cccnc12)c1ccccc1OC.
What is the InChIKey of ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine?
The InChIKey is JFOHQOHUFAUTQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O.C2H6/c1-3-16(18-10-4-5-12-20(18)24-2)13-15-22-19-11-6-8-17-9-7-14-23-21(17)19;1-2/h4-12,14,16,22H,3,13,15H2,1-2H3;1-2H3.
What are the key properties of ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine?
ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine has a molecular weight of 350.51 g/mol, XLogP of 6.27, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[3-(2-methoxyphenyl)pentyl]quinolin-8-amine is sourced from PubChem (CID 145081075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).