N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine

C15H21N3O — CID 63287108

IUPACN'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine
SMILESCOCCN(CCCN)c1ccnc2ccccc12
InChIInChI=1S/C15H21N3O/c1-19-12-11-18(10-4-8-16)15-7-9-17-14-6-3-2-5-13(14)15/h2-3,5-7,9H,4,8,10-12,16H2,1H3
InChIKeyXHBDYCPBUYSPTQ-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.04
Rot. Bonds7

About N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine

N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine (PubChem CID 63287108) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine
PubChem CID63287108
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine
SMILESCOCCN(CCCN)c1ccnc2ccccc12
InChIInChI=1S/C15H21N3O/c1-19-12-11-18(10-4-8-16)15-7-9-17-14-6-3-2-5-13(14)15/h2-3,5-7,9H,4,8,10-12,16H2,1H3
InChIKeyXHBDYCPBUYSPTQ-UHFFFAOYSA-N
XLogP2.04
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-propyl-N'-quinolin-4-ylethane-1,2-diamine
CID 55241600
N'-ethyl-N'-quinolin-4-ylethane-1,2-diamine
CID 63765878
N'-(2-methoxyethyl)-N'-pyrimidin-2-ylpropane-1,3-diamine
CID 63287337
N'-(2-fluorophenyl)-N'-(3-methoxypropyl)propane-1,3-diamine
CID 54935456
N,N-bis(2-methoxyethyl)quinazolin-4-amine
CID 21104388
N'-(7-chloroquinolin-4-yl)-N'-[3-(diethylamino)propyl]propane-1,3-diamine
CID 66921220
4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine
CID 67124581
N-(3-aminopropyl)-N-(2-methoxyethyl)isoquinoline-1-carboxamide
CID 63287507
N'-(2-methoxyethyl)-N'-pyrazin-2-ylpropane-1,3-diamine
CID 63287295
N'-(2-methoxyethyl)-N'-(5-methylpyrimidin-2-yl)propane-1,3-diamine
CID 63287741
N'-(2-methoxyethyl)-N'-(3-methylsulfonyl-2-pyridinyl)propane-1,3-diamine
CID 114598399
4-N-ethyl-4-N-(2-methoxyethyl)quinoline-3,4-diamine
CID 103962995

Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine?
The IUPAC name of N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine (CID 63287108) is N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine.
What is the SMILES notation for N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine?
The canonical SMILES for N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine is COCCN(CCCN)c1ccnc2ccccc12.
What is the InChIKey of N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine?
The InChIKey is XHBDYCPBUYSPTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-19-12-11-18(10-4-8-16)15-7-9-17-14-6-3-2-5-13(14)15/h2-3,5-7,9H,4,8,10-12,16H2,1H3.
What are the key properties of N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine?
N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine has a molecular weight of 259.35 g/mol, XLogP of 2.04, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine is sourced from PubChem (CID 63287108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).