3-(2-methylbutoxy)quinolin-2-amine

C14H18N2O — CID 118174550

IUPAC3-(2-methylbutoxy)quinolin-2-amine
SMILESCCC(C)COc1cc2ccccc2nc1N
InChIInChI=1S/C14H18N2O/c1-3-10(2)9-17-13-8-11-6-4-5-7-12(11)16-14(13)15/h4-8,10H,3,9H2,1-2H3,(H2,15,16)
InChIKeyYZWADUOSJBYTTM-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.24
Rot. Bonds4

About 3-(2-methylbutoxy)quinolin-2-amine

3-(2-methylbutoxy)quinolin-2-amine (PubChem CID 118174550) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-(2-methylbutoxy)quinolin-2-amine.

Molecular Properties

Compound Name3-(2-methylbutoxy)quinolin-2-amine
PubChem CID118174550
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name3-(2-methylbutoxy)quinolin-2-amine
SMILESCCC(C)COc1cc2ccccc2nc1N
InChIInChI=1S/C14H18N2O/c1-3-10(2)9-17-13-8-11-6-4-5-7-12(11)16-14(13)15/h4-8,10H,3,9H2,1-2H3,(H2,15,16)
InChIKeyYZWADUOSJBYTTM-UHFFFAOYSA-N
XLogP3.24
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-butan-2-ylquinolin-2-amine
CID 118184851
3-[5-(4-methoxyphenoxy)pentan-2-yloxy]quinolin-2-amine
CID 70038950
3-(2-methylbutoxy)naphthalene-2-carboxylic acid
CID 62104724
3-(3-pyrrolidin-1-ylpropoxy)quinolin-2-amine
CID 175884266
3-[[butan-2-yl(2-methoxyethyl)amino]methyl]quinolin-2-amine
CID 62209123
3-[(2-ethoxyphenyl)methyl]quinolin-2-amine;hydrochloride
CID 68554141
4-bromo-3-(2-methylbutoxy)aniline
CID 103008806
1-[(2S)-2-methylbutoxy]-2-phenylbenzene
CID 57221058
3-(2-methylpropoxy)quinoxalin-2-amine
CID 102987688
5-methoxy-2-(2-methylbutoxy)aniline
CID 62103254
3-N-ethyl-3-N-(2-methylbutyl)quinoxaline-2,3-diamine
CID 102986815
2-propan-2-ylquinolin-3-ol;5-(2-propan-2-ylquinolin-3-yl)oxypyrimidine-2,4-diamine
CID 157053933

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylbutoxy)quinolin-2-amine?
The IUPAC name of 3-(2-methylbutoxy)quinolin-2-amine (CID 118174550) is 3-(2-methylbutoxy)quinolin-2-amine.
What is the SMILES notation for 3-(2-methylbutoxy)quinolin-2-amine?
The canonical SMILES for 3-(2-methylbutoxy)quinolin-2-amine is CCC(C)COc1cc2ccccc2nc1N.
What is the InChIKey of 3-(2-methylbutoxy)quinolin-2-amine?
The InChIKey is YZWADUOSJBYTTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-3-10(2)9-17-13-8-11-6-4-5-7-12(11)16-14(13)15/h4-8,10H,3,9H2,1-2H3,(H2,15,16).
What are the key properties of 3-(2-methylbutoxy)quinolin-2-amine?
3-(2-methylbutoxy)quinolin-2-amine has a molecular weight of 230.31 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylbutoxy)quinolin-2-amine is sourced from PubChem (CID 118174550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).