6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine

C17H25N3 — CID 63481209

IUPAC6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine
SMILESCCCNc1cc(C(C)C)nc2ccc(N(C)C)cc12
InChIInChI=1S/C17H25N3/c1-6-9-18-17-11-16(12(2)3)19-15-8-7-13(20(4)5)10-14(15)17/h7-8,10-12H,6,9H2,1-5H3,(H,18,19)
InChIKeyCHDZHWZSVJDHKU-UHFFFAOYSA-N
MW271.41 g/mol
LogP4.25
Rot. Bonds5

About 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine

6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine (PubChem CID 63481209) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine.

Molecular Properties

Compound Name6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine
PubChem CID63481209
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC Name6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine
SMILESCCCNc1cc(C(C)C)nc2ccc(N(C)C)cc12
InChIInChI=1S/C17H25N3/c1-6-9-18-17-11-16(12(2)3)19-15-8-7-13(20(4)5)10-14(15)17/h7-8,10-12H,6,9H2,1-5H3,(H,18,19)
InChIKeyCHDZHWZSVJDHKU-UHFFFAOYSA-N
XLogP4.25
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 14710
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CID 62344
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CID 2993
CID 2993
CID 2723754
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CID 7019
CID 7019
CID 6842
CID 6842
CID 8643
CID 8643
CID 20628
CID 20628
CID 81116
CID 81116

Frequently Asked Questions

What is the IUPAC name of 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine?
The IUPAC name of 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine (CID 63481209) is 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine.
What is the SMILES notation for 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine?
The canonical SMILES for 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine is CCCNc1cc(C(C)C)nc2ccc(N(C)C)cc12.
What is the InChIKey of 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine?
The InChIKey is CHDZHWZSVJDHKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-6-9-18-17-11-16(12(2)3)19-15-8-7-13(20(4)5)10-14(15)17/h7-8,10-12H,6,9H2,1-5H3,(H,18,19).
What are the key properties of 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine?
6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine has a molecular weight of 271.41 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,6-N-dimethyl-2-propan-2-yl-4-N-propylquinoline-4,6-diamine is sourced from PubChem (CID 63481209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).