5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine

C16H22N2O3 — CID 63231688

IUPAC5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine
SMILESCCCNc1nc2cc(OC)c(OC)c(OC)c2cc1C
InChIInChI=1S/C16H22N2O3/c1-6-7-17-16-10(2)8-11-12(18-16)9-13(19-3)15(21-5)14(11)20-4/h8-9H,6-7H2,1-5H3,(H,17,18)
InChIKeyBQIXQENLKOZRSG-UHFFFAOYSA-N
MW290.36 g/mol
LogP3.39
Rot. Bonds6

About 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine

5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine (PubChem CID 63231688) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine.

Molecular Properties

Compound Name5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine
PubChem CID63231688
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine
SMILESCCCNc1nc2cc(OC)c(OC)c(OC)c2cc1C
InChIInChI=1S/C16H22N2O3/c1-6-7-17-16-10(2)8-11-12(18-16)9-13(19-3)15(21-5)14(11)20-4/h8-9H,6-7H2,1-5H3,(H,17,18)
InChIKeyBQIXQENLKOZRSG-UHFFFAOYSA-N
XLogP3.39
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,5,7-trimethyl-N-propylquinolin-2-amine
CID 55224112
5,6,7-trifluoro-3-methyl-N-propylquinolin-2-amine
CID 63232523
6,7-dimethoxy-2,3-dimethyl-N-propylquinolin-4-amine
CID 62203946
6-chloro-7-methoxy-2-methyl-N-propylquinolin-4-amine
CID 107623108
N-butyl-2-chloro-6,7-dimethoxyquinazolin-4-amine
CID 22692586
2-N,3-N-diethyl-6,7-dimethoxyquinoxaline-2,3-diamine
CID 56953586
6,7-dimethoxy-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62203771
5-bromo-8-chloro-3-methyl-N-propylquinolin-2-amine
CID 63524554
5,8-dichloro-3,6-dimethyl-N-propylquinolin-2-amine
CID 104728365
6-bromo-7-fluoro-3-methyl-N-propylquinolin-2-amine
CID 103997014
3-ethyl-5,8-dimethoxy-N-propylquinolin-2-amine
CID 63524526
2-(butylamino)-4-chloro-6,7-dimethoxyquinoline-3-carboxylic acid
CID 151134940

Frequently Asked Questions

What is the IUPAC name of 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine?
The IUPAC name of 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine (CID 63231688) is 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine.
What is the SMILES notation for 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine?
The canonical SMILES for 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine is CCCNc1nc2cc(OC)c(OC)c(OC)c2cc1C.
What is the InChIKey of 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine?
The InChIKey is BQIXQENLKOZRSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-6-7-17-16-10(2)8-11-12(18-16)9-13(19-3)15(21-5)14(11)20-4/h8-9H,6-7H2,1-5H3,(H,17,18).
What are the key properties of 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine?
5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine has a molecular weight of 290.36 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7-trimethoxy-3-methyl-N-propylquinolin-2-amine is sourced from PubChem (CID 63231688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).