2-(methylamino)-4-quinolin-7-yloxybutan-1-ol

C14H18N2O2 — CID 107315572

IUPAC2-(methylamino)-4-quinolin-7-yloxybutan-1-ol
SMILESCNC(CO)CCOc1ccc2cccnc2c1
InChIInChI=1S/C14H18N2O2/c1-15-12(10-17)6-8-18-13-5-4-11-3-2-7-16-14(11)9-13/h2-5,7,9,12,15,17H,6,8,10H2,1H3
InChIKeyAGCMDKPPGXIGEA-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.58
Rot. Bonds6

About 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol

2-(methylamino)-4-quinolin-7-yloxybutan-1-ol (PubChem CID 107315572) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol.

Molecular Properties

Compound Name2-(methylamino)-4-quinolin-7-yloxybutan-1-ol
PubChem CID107315572
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2-(methylamino)-4-quinolin-7-yloxybutan-1-ol
SMILESCNC(CO)CCOc1ccc2cccnc2c1
InChIInChI=1S/C14H18N2O2/c1-15-12(10-17)6-8-18-13-5-4-11-3-2-7-16-14(11)9-13/h2-5,7,9,12,15,17H,6,8,10H2,1H3
InChIKeyAGCMDKPPGXIGEA-UHFFFAOYSA-N
XLogP1.58
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-quinolin-7-yloxyhexan-3-amine
CID 107313514
6-quinolin-7-yloxyhexan-1-ol
CID 107705479
2-(methylamino)-3-quinolin-7-yloxypropanoic acid
CID 107314757
N-ethyl-2-quinolin-7-yloxyethanamine
CID 107313475
3-quinolin-7-yloxypropanal
CID 107314214
2-(methylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)butan-1-ol
CID 64810805
3-quinolin-7-yloxypropane-1-thiol
CID 107315768
N-propan-2-yl-5-quinolin-7-yloxypentan-1-amine
CID 107314998
N-methyl-2-quinolin-7-yloxypropan-1-amine
CID 107313762
N',N'-dimethyl-N-(2-quinolin-7-yloxyethyl)ethane-1,2-diamine
CID 107315215
N-(2-quinolin-7-yloxyethyl)cyclohexanamine
CID 107315321
N-(4-quinolin-7-yloxybutyl)cyclopropanamine
CID 107314991

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol?
The IUPAC name of 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol (CID 107315572) is 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol.
What is the SMILES notation for 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol?
The canonical SMILES for 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol is CNC(CO)CCOc1ccc2cccnc2c1.
What is the InChIKey of 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol?
The InChIKey is AGCMDKPPGXIGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-15-12(10-17)6-8-18-13-5-4-11-3-2-7-16-14(11)9-13/h2-5,7,9,12,15,17H,6,8,10H2,1H3.
What are the key properties of 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol?
2-(methylamino)-4-quinolin-7-yloxybutan-1-ol has a molecular weight of 246.31 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-4-quinolin-7-yloxybutan-1-ol is sourced from PubChem (CID 107315572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).