N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine

C16H23N3 — CID 107442200

IUPACN'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine
SMILESCc1ccc2cccc(NCC(CN)C(C)C)c2n1
InChIInChI=1S/C16H23N3/c1-11(2)14(9-17)10-18-15-6-4-5-13-8-7-12(3)19-16(13)15/h4-8,11,14,18H,9-10,17H2,1-3H3
InChIKeyUHSPJWFSTUZGFK-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.19
Rot. Bonds5

About N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine

N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine (PubChem CID 107442200) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine
PubChem CID107442200
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC NameN'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine
SMILESCc1ccc2cccc(NCC(CN)C(C)C)c2n1
InChIInChI=1S/C16H23N3/c1-11(2)14(9-17)10-18-15-6-4-5-13-8-7-12(3)19-16(13)15/h4-8,11,14,18H,9-10,17H2,1-3H3
InChIKeyUHSPJWFSTUZGFK-UHFFFAOYSA-N
XLogP3.19
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methylquinolin-8-yl)hydrazine
CID 957615
2-amino-N-(2-methylquinolin-8-yl)acetamide
CID 62952419
2-methyl-N-[(2-methylphenyl)methyl]quinolin-8-amine
CID 62954281
N-[(2,6-difluorophenyl)methyl]-2-methylquinolin-8-amine
CID 62954438
2-methyl-3-(methylamino)-N-(2-methylquinolin-8-yl)propanamide
CID 79201712
N'-[2-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]-2-propan-2-ylpropane-1,3-diamine
CID 107441440
(2R)-2-amino-3,3-dimethyl-N-(2-methylquinolin-8-yl)butanamide
CID 103929864
3-N-(2-methylquinolin-8-yl)pyridine-2,3-diamine
CID 104540323
3,3-dimethyl-N-(2-methylquinolin-8-yl)butanamide
CID 110734160
N-(2-methylquinolin-8-yl)-3-(propan-2-ylamino)propanamide
CID 62954985
2-methyl-8-(sulfamoylamino)quinoline
CID 112573710
2-[(2-methylquinolin-8-yl)amino]propanoic acid
CID 66173350

Frequently Asked Questions

What is the IUPAC name of N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine (CID 107442200) is N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine is Cc1ccc2cccc(NCC(CN)C(C)C)c2n1.
What is the InChIKey of N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine?
The InChIKey is UHSPJWFSTUZGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-11(2)14(9-17)10-18-15-6-4-5-13-8-7-12(3)19-16(13)15/h4-8,11,14,18H,9-10,17H2,1-3H3.
What are the key properties of N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine?
N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine has a molecular weight of 257.38 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methylquinolin-8-yl)-2-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 107442200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).