4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile

C15H17N3O2 — CID 82247580

IUPAC4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile
SMILESCOc1cc(OC)c2nc(C)c(C#N)c(N(C)C)c2c1
InChIInChI=1S/C15H17N3O2/c1-9-12(8-16)15(18(2)3)11-6-10(19-4)7-13(20-5)14(11)17-9/h6-7H,1-5H3
InChIKeyVCEZQZIPBXQLFG-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.50
Rot. Bonds3

About 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile

4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile (PubChem CID 82247580) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile.

Molecular Properties

Compound Name4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile
PubChem CID82247580
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile
SMILESCOc1cc(OC)c2nc(C)c(C#N)c(N(C)C)c2c1
InChIInChI=1S/C15H17N3O2/c1-9-12(8-16)15(18(2)3)11-6-10(19-4)7-13(20-5)14(11)17-9/h6-7H,1-5H3
InChIKeyVCEZQZIPBXQLFG-UHFFFAOYSA-N
XLogP2.50
TPSA58.38 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(aminomethyl)-6,8-dimethoxy-N,N,3-trimethylquinolin-4-amine
CID 82248240
2,4-dimethoxy-6-methylbenzonitrile
CID 11435258
4-chloro-6,8-dimethoxy-2-methylquinazoline
CID 89399960
3-(6,8-dimethoxy-3,4-dimethylpyrazolo[4,3-c]quinolin-1-yl)benzonitrile
CID 110173773
4-chloro-2-ethyl-6,8-dimethoxyquinoline
CID 43668808
2-amino-5,7-dimethoxy-1H-indole-3-carbonitrile
CID 166518306
2-[4-(dimethylamino)-6,8-dimethoxyquinolin-2-yl]acetic acid
CID 39234665
1-(6,8-dimethoxy-2-methylquinolin-3-yl)-N-methylmethanamine
CID 82244248
6,8-dimethoxyisoquinoline-4-carbonitrile
CID 57440605
2-amino-6-(4-methoxyphenyl)-4-(2,4,6-trimethoxyphenyl)pyridine-3-carbonitrile
CID 3375509
4-(dimethylamino)-8-methoxyquinoline-2-carbonitrile
CID 82242563
6,8-dimethoxy-4-methylquinoline-2-carbothioamide
CID 82574234

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile?
The IUPAC name of 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile (CID 82247580) is 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile.
What is the SMILES notation for 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile?
The canonical SMILES for 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile is COc1cc(OC)c2nc(C)c(C#N)c(N(C)C)c2c1.
What is the InChIKey of 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile?
The InChIKey is VCEZQZIPBXQLFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-9-12(8-16)15(18(2)3)11-6-10(19-4)7-13(20-5)14(11)17-9/h6-7H,1-5H3.
What are the key properties of 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile?
4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile has a molecular weight of 271.32 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-6,8-dimethoxy-2-methylquinoline-3-carbonitrile is sourced from PubChem (CID 82247580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).