N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine

C15H21N3 — CID 29034391

IUPACN',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine
SMILESCCN(CC)CCNc1ccc2ccccc2n1
InChIInChI=1S/C15H21N3/c1-3-18(4-2)12-11-16-15-10-9-13-7-5-6-8-14(13)17-15/h5-10H,3-4,11-12H2,1-2H3,(H,16,17)
InChIKeyUPLGKPZWFWQQSF-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.99
Rot. Bonds6

About N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine

N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine (PubChem CID 29034391) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine
PubChem CID29034391
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine
SMILESCCN(CC)CCNc1ccc2ccccc2n1
InChIInChI=1S/C15H21N3/c1-3-18(4-2)12-11-16-15-10-9-13-7-5-6-8-14(13)17-15/h5-10H,3-4,11-12H2,1-2H3,(H,16,17)
InChIKeyUPLGKPZWFWQQSF-UHFFFAOYSA-N
XLogP2.99
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N,9-N-bis[2-(diethylamino)ethyl]-1,10-phenanthroline-2,9-diamine
CID 100984113
N-dodecylquinolin-2-amine
CID 160510159
2-[2-hydroxyethyl-[3-(quinolin-2-ylamino)propyl]amino]ethanol
CID 21424676
6-N-[2-(diethylamino)ethyl]pyridine-2,3,6-triamine
CID 79822537
1-N-quinolin-2-ylbutane-1,3-diamine
CID 63251635
6-N-[2-(diethylamino)ethyl]pyridine-2,6-diamine
CID 10856706
(4S)-1-N,1-N-diethyl-4-N-quinolin-2-ylpentane-1,4-diamine
CID 36691119
3-(quinolin-2-ylamino)propan-1-ol
CID 581988
N-(2-phenylethyl)quinolin-2-amine
CID 29300407
3-N-[2-(diethylamino)ethyl]quinoxaline-2,3-diamine
CID 102983578
N-(1-chloroisoquinolin-3-yl)-N',N'-diethylethane-1,2-diamine
CID 133381320
N-propyl-3-(quinolin-2-ylamino)propanamide
CID 61065980

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine (CID 29034391) is N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine is CCN(CC)CCNc1ccc2ccccc2n1.
What is the InChIKey of N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine?
The InChIKey is UPLGKPZWFWQQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-3-18(4-2)12-11-16-15-10-9-13-7-5-6-8-14(13)17-15/h5-10H,3-4,11-12H2,1-2H3,(H,16,17).
What are the key properties of N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine?
N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine has a molecular weight of 243.35 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-quinolin-2-ylethane-1,2-diamine is sourced from PubChem (CID 29034391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).