4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine

C14H20N4 — CID 103000943

IUPAC4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine
SMILESCC(CNc1ccnc2cc(N)ccc12)N(C)C
InChIInChI=1S/C14H20N4/c1-10(18(2)3)9-17-13-6-7-16-14-8-11(15)4-5-12(13)14/h4-8,10H,9,15H2,1-3H3,(H,16,17)
InChIKeyFUPMPZXYHCHNRQ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.18
Rot. Bonds4

About 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine

4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine (PubChem CID 103000943) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine.

Molecular Properties

Compound Name4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine
PubChem CID103000943
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine
SMILESCC(CNc1ccnc2cc(N)ccc12)N(C)C
InChIInChI=1S/C14H20N4/c1-10(18(2)3)9-17-13-6-7-16-14-8-11(15)4-5-12(13)14/h4-8,10H,9,15H2,1-3H3,(H,16,17)
InChIKeyFUPMPZXYHCHNRQ-UHFFFAOYSA-N
XLogP2.18
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-N-[2-[ethyl(methyl)amino]ethyl]quinoline-4,7-diamine
CID 103001063
4-N-[3-[methyl(propan-2-yl)amino]propyl]quinoline-4,7-diamine
CID 106036752
2-[(7-aminoquinolin-4-yl)amino]-1-cyclopropylethanol
CID 103001162
2-[(7-aminoquinolin-4-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106780
3-[(7-aminoquinolin-4-yl)amino]-2,2-dimethylpropan-1-ol
CID 103001581
4-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]quinoline-4,7-diamine
CID 103001451
3-[(7-aminoquinolin-4-yl)amino]-N-butan-2-ylpropanamide
CID 103000927
4-N-(3-butoxypropyl)quinoline-4,7-diamine
CID 103001799
4-N-but-3-enylquinoline-4,7-diamine
CID 103001772
4-N-(2,4,4-trimethylpentan-2-yl)quinoline-4,7-diamine
CID 103000881
4-N-[(4-methylcyclohexyl)methyl]quinoline-4,7-diamine
CID 103001147
3-[(7-aminoquinolin-4-yl)amino]-N-propylpropanamide
CID 103000936

Frequently Asked Questions

What is the IUPAC name of 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine?
The IUPAC name of 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine (CID 103000943) is 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine.
What is the SMILES notation for 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine?
The canonical SMILES for 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine is CC(CNc1ccnc2cc(N)ccc12)N(C)C.
What is the InChIKey of 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine?
The InChIKey is FUPMPZXYHCHNRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-10(18(2)3)9-17-13-6-7-16-14-8-11(15)4-5-12(13)14/h4-8,10H,9,15H2,1-3H3,(H,16,17).
What are the key properties of 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine?
4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine has a molecular weight of 244.34 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[2-(dimethylamino)propyl]quinoline-4,7-diamine is sourced from PubChem (CID 103000943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).