N'-quinolin-4-ylpentane-1,5-diamine

C14H19N3 — CID 107323516

IUPACN'-quinolin-4-ylpentane-1,5-diamine
SMILESNCCCCCNc1ccnc2ccccc12
InChIInChI=1S/C14H19N3/c15-9-4-1-5-10-16-14-8-11-17-13-7-3-2-6-12(13)14/h2-3,6-8,11H,1,4-5,9-10,15H2,(H,16,17)
InChIKeyYECGPPLHAXUGRP-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.78
Rot. Bonds6

About N'-quinolin-4-ylpentane-1,5-diamine

N'-quinolin-4-ylpentane-1,5-diamine (PubChem CID 107323516) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is N'-quinolin-4-ylpentane-1,5-diamine.

Molecular Properties

Compound NameN'-quinolin-4-ylpentane-1,5-diamine
PubChem CID107323516
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC NameN'-quinolin-4-ylpentane-1,5-diamine
SMILESNCCCCCNc1ccnc2ccccc12
InChIInChI=1S/C14H19N3/c15-9-4-1-5-10-16-14-8-11-17-13-7-3-2-6-12(13)14/h2-3,6-8,11H,1,4-5,9-10,15H2,(H,16,17)
InChIKeyYECGPPLHAXUGRP-UHFFFAOYSA-N
XLogP2.78
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-butoxyhexan-1-amine;N-(6-butoxyhexyl)quinolin-4-amine
CID 118576144
N-(5-chloropentyl)quinolin-4-amine
CID 107320544
N-methyl-N'-quinolin-4-ylethane-1,2-diamine
CID 62658935
methyl 6-(quinolin-4-ylamino)hexanoate
CID 62005474
N-(4-aminobutyl)-2-hexoxybenzamide;2-hexoxy-N-[4-(quinolin-4-ylamino)butyl]benzamide
CID 90319067
N'-quinolin-5-ylethane-1,2-diamine
CID 81217065
5-quinolin-4-ylpentan-1-amine
CID 71089574
N-ethylquinolin-4-amine
CID 15306588
N,N'-bis(7-chloroquinolin-4-yl)octane-1,8-diamine;hydrochloride
CID 44531641
N-quinolin-4-yl-N'-(1,2,3,4-tetrahydroacridin-9-yl)heptane-1,7-diamine
CID 11743869
4-quinolin-4-ylbutan-1-amine
CID 10559963
N-[[2-[(quinolin-4-ylamino)methyl]phenyl]methyl]quinolin-4-amine
CID 67723222

Frequently Asked Questions

What is the IUPAC name of N'-quinolin-4-ylpentane-1,5-diamine?
The IUPAC name of N'-quinolin-4-ylpentane-1,5-diamine (CID 107323516) is N'-quinolin-4-ylpentane-1,5-diamine.
What is the SMILES notation for N'-quinolin-4-ylpentane-1,5-diamine?
The canonical SMILES for N'-quinolin-4-ylpentane-1,5-diamine is NCCCCCNc1ccnc2ccccc12.
What is the InChIKey of N'-quinolin-4-ylpentane-1,5-diamine?
The InChIKey is YECGPPLHAXUGRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c15-9-4-1-5-10-16-14-8-11-17-13-7-3-2-6-12(13)14/h2-3,6-8,11H,1,4-5,9-10,15H2,(H,16,17).
What are the key properties of N'-quinolin-4-ylpentane-1,5-diamine?
N'-quinolin-4-ylpentane-1,5-diamine has a molecular weight of 229.33 g/mol, XLogP of 2.78, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-quinolin-4-ylpentane-1,5-diamine is sourced from PubChem (CID 107323516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).