4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine

C17H25N3 — CID 67124581

IUPAC4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine
SMILESCCC(CCCN)N(CC)c1ccnc2ccccc12
InChIInChI=1S/C17H25N3/c1-3-14(8-7-12-18)20(4-2)17-11-13-19-16-10-6-5-9-15(16)17/h5-6,9-11,13-14H,3-4,7-8,12,18H2,1-2H3
InChIKeyNSFCKKCLIUFAQT-UHFFFAOYSA-N
MW271.41 g/mol
LogP3.58
Rot. Bonds7

About 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine

4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine (PubChem CID 67124581) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine.

Molecular Properties

Compound Name4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine
PubChem CID67124581
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC Name4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine
SMILESCCC(CCCN)N(CC)c1ccnc2ccccc12
InChIInChI=1S/C17H25N3/c1-3-14(8-7-12-18)20(4-2)17-11-13-19-16-10-6-5-9-15(16)17/h5-6,9-11,13-14H,3-4,7-8,12,18H2,1-2H3
InChIKeyNSFCKKCLIUFAQT-UHFFFAOYSA-N
XLogP3.58
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-ethyl-N'-quinolin-4-ylethane-1,2-diamine
CID 63765878
(1R)-1-quinolin-4-ylbutane-1,4-diamine;hydrochloride
CID 171216978
3-N-ethyl-3-N-naphthalen-1-ylpentane-1,3-diamine
CID 43428349
N'-propyl-N'-quinolin-4-ylethane-1,2-diamine
CID 55241600
2-[propan-2-yl(quinolin-4-yl)amino]ethanol
CID 61339739
N'-pentan-3-yl-N'-(quinolin-4-ylmethyl)ethane-1,2-diamine
CID 79240886
N'-(2-methoxyethyl)-N'-quinolin-4-ylpropane-1,3-diamine
CID 63287108
(1S)-1-quinolin-4-ylpropan-1-amine;hydrochloride
CID 171236618
(1S)-1-quinolin-4-ylhexan-1-amine
CID 171236624
N'-(7-chloroquinolin-4-yl)-N'-propan-2-ylpropane-1,3-diamine
CID 60869676
4-quinolin-4-ylbutan-1-amine
CID 10559963
3-N-quinolin-4-ylbutane-1,3-diamine
CID 83179618

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine?
The IUPAC name of 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine (CID 67124581) is 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine.
What is the SMILES notation for 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine?
The canonical SMILES for 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine is CCC(CCCN)N(CC)c1ccnc2ccccc12.
What is the InChIKey of 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine?
The InChIKey is NSFCKKCLIUFAQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-3-14(8-7-12-18)20(4-2)17-11-13-19-16-10-6-5-9-15(16)17/h5-6,9-11,13-14H,3-4,7-8,12,18H2,1-2H3.
What are the key properties of 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine?
4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine has a molecular weight of 271.41 g/mol, XLogP of 3.58, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-4-N-quinolin-4-ylhexane-1,4-diamine is sourced from PubChem (CID 67124581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).