N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine

C18H27N3 — CID 82107801

IUPACN',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine
SMILESCCCN(CCC)CC(CN)c1cnc2ccccc2c1
InChIInChI=1S/C18H27N3/c1-3-9-21(10-4-2)14-17(12-19)16-11-15-7-5-6-8-18(15)20-13-16/h5-8,11,13,17H,3-4,9-10,12,14,19H2,1-2H3
InChIKeyKDAMKXGETPGZEI-UHFFFAOYSA-N
MW285.44 g/mol
LogP3.40
Rot. Bonds8

About N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine

N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine (PubChem CID 82107801) has the molecular formula C18H27N3 and a molecular weight of 285.44 g/mol. Its IUPAC name is N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine
PubChem CID82107801
Molecular FormulaC18H27N3
Molecular Weight285.44 g/mol
Exact Mass285.22
IUPAC NameN',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine
SMILESCCCN(CCC)CC(CN)c1cnc2ccccc2c1
InChIInChI=1S/C18H27N3/c1-3-9-21(10-4-2)14-17(12-19)16-11-15-7-5-6-8-18(15)20-13-16/h5-8,11,13,17H,3-4,9-10,12,14,19H2,1-2H3
InChIKeyKDAMKXGETPGZEI-UHFFFAOYSA-N
XLogP3.40
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.44
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-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

1-quinolin-3-ylbutylhydrazine
CID 105202157
1-quinolin-3-ylbutan-1-ol
CID 60924193
1-quinolin-3-ylnonylhydrazine
CID 105286952
2-methyl-3-quinolin-3-ylpropan-1-amine
CID 64664749
ethyl (3S)-3-amino-3-quinolin-3-ylpropanoate
CID 34177500
2-ethoxy-1-quinolin-3-ylbutan-1-amine
CID 116716202
2-amino-2-quinolin-3-ylethanol;ethene
CID 142317274
2-phenyl-1-quinolin-3-ylbutan-1-amine
CID 115798275
2-quinolin-3-ylbutanamide
CID 154121490
2-quinolin-3-yloxybutan-1-amine
CID 107386996
(3-ethyl-1,4-dithian-2-yl)-quinolin-3-ylmethanamine
CID 115387663
(1S)-1-quinolin-3-ylbut-3-en-1-amine
CID 55271973

Frequently Asked Questions

What is the IUPAC name of N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine?
The IUPAC name of N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine (CID 82107801) is N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine.
What is the SMILES notation for N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine?
The canonical SMILES for N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine is CCCN(CCC)CC(CN)c1cnc2ccccc2c1.
What is the InChIKey of N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine?
The InChIKey is KDAMKXGETPGZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3/c1-3-9-21(10-4-2)14-17(12-19)16-11-15-7-5-6-8-18(15)20-13-16/h5-8,11,13,17H,3-4,9-10,12,14,19H2,1-2H3.
What are the key properties of N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine?
N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine has a molecular weight of 285.44 g/mol, XLogP of 3.40, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dipropyl-2-quinolin-3-ylpropane-1,3-diamine is sourced from PubChem (CID 82107801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).