5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine

C15H19N3 — CID 43382838

IUPAC5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine
SMILESCN(c1ccc(N)c2ncccc12)C1CCCC1
InChIInChI=1S/C15H19N3/c1-18(11-5-2-3-6-11)14-9-8-13(16)15-12(14)7-4-10-17-15/h4,7-11H,2-3,5-6,16H2,1H3
InChIKeySMJQIOMITKQIIL-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.20
Rot. Bonds2

About 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine

5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine (PubChem CID 43382838) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine.

Molecular Properties

Compound Name5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine
PubChem CID43382838
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine
SMILESCN(c1ccc(N)c2ncccc12)C1CCCC1
InChIInChI=1S/C15H19N3/c1-18(11-5-2-3-6-11)14-9-8-13(16)15-12(14)7-4-10-17-15/h4,7-11H,2-3,5-6,16H2,1H3
InChIKeySMJQIOMITKQIIL-UHFFFAOYSA-N
XLogP3.20
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-N-methyl-5-N-(oxan-3-ylmethyl)quinoline-5,8-diamine
CID 63726625
5-[4-(dimethylamino)piperidin-1-yl]quinolin-8-amine
CID 43585725
2-N-cyclopentyl-2-N-methylbenzene-1,2-diamine
CID 43266943
5-N-propan-2-yl-5-N-propylquinoline-5,8-diamine
CID 43382839
5-N-methyl-5-N-(pyridin-3-ylmethyl)quinoline-5,8-diamine
CID 43563386
5-methylsulfinylquinolin-8-amine
CID 164876860
5-N-(2,6-dimethylpiperidin-1-yl)quinoline-5,8-diamine
CID 83004330
2-[(5-aminoquinolin-6-yl)-methylamino]cyclohexan-1-ol
CID 102631412
5-N-ethyl-5-N-(2-methylbutyl)quinoline-5,8-diamine
CID 79477409
5-N-[1-(dimethylamino)propan-2-yl]quinoline-5,8-diamine
CID 82945198
2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine
CID 43264702
5-N-methyl-5-N-(1,3-thiazol-4-ylmethyl)quinoline-5,8-diamine
CID 55013762

Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine?
The IUPAC name of 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine (CID 43382838) is 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine.
What is the SMILES notation for 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine?
The canonical SMILES for 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine is CN(c1ccc(N)c2ncccc12)C1CCCC1.
What is the InChIKey of 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine?
The InChIKey is SMJQIOMITKQIIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-18(11-5-2-3-6-11)14-9-8-13(16)15-12(14)7-4-10-17-15/h4,7-11H,2-3,5-6,16H2,1H3.
What are the key properties of 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine?
5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine has a molecular weight of 241.34 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopentyl-5-N-methylquinoline-5,8-diamine is sourced from PubChem (CID 43382838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).