3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol

C16H26N2O — CID 64796022

IUPAC3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol
SMILESCCCNC(CO)CN1CCCc2cc(C)ccc21
InChIInChI=1S/C16H26N2O/c1-3-8-17-15(12-19)11-18-9-4-5-14-10-13(2)6-7-16(14)18/h6-7,10,15,17,19H,3-5,8-9,11-12H2,1-2H3
InChIKeyKGNDYDHKFURISI-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.11
Rot. Bonds6

About 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol

3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol (PubChem CID 64796022) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol.

Molecular Properties

Compound Name3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol
PubChem CID64796022
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol
SMILESCCCNC(CO)CN1CCCc2cc(C)ccc21
InChIInChI=1S/C16H26N2O/c1-3-8-17-15(12-19)11-18-9-4-5-14-10-13(2)6-7-16(14)18/h6-7,10,15,17,19H,3-5,8-9,11-12H2,1-2H3
InChIKeyKGNDYDHKFURISI-UHFFFAOYSA-N
XLogP2.11
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol with MolForge

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Related Compounds

N-methyl-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-2-amine
CID 62041176
4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propan-2-ylamino)butan-1-ol
CID 64797111
N-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]propan-2-amine
CID 60841491
N-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]butan-2-amine
CID 60854306
1-amino-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 24698210
2-methyl-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanoic acid
CID 43538734
ethane;1-ethyl-6-methyl-3,4-dihydro-2H-quinoline
CID 143643901
1-ethoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 63934170
1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine
CID 81102110
N-methyl-4-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-amine
CID 60840997
2-[6-[1-(propylamino)ethyl]-3,4-dihydro-2H-quinolin-1-yl]ethanol
CID 102662122
1-(cyclopropylamino)-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 43343115

Frequently Asked Questions

What is the IUPAC name of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
The IUPAC name of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol (CID 64796022) is 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol.
What is the SMILES notation for 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
The canonical SMILES for 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol is CCCNC(CO)CN1CCCc2cc(C)ccc21.
What is the InChIKey of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
The InChIKey is KGNDYDHKFURISI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-8-17-15(12-19)11-18-9-4-5-14-10-13(2)6-7-16(14)18/h6-7,10,15,17,19H,3-5,8-9,11-12H2,1-2H3.
What are the key properties of 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol?
3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol has a molecular weight of 262.40 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol is sourced from PubChem (CID 64796022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).