4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline

C18H19N3 — CID 102212163

IUPAC4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline
SMILESCc1ccc2nc(-c3ccc(N(C)C)cc3)nc(C)c2c1
InChIInChI=1S/C18H19N3/c1-12-5-10-17-16(11-12)13(2)19-18(20-17)14-6-8-15(9-7-14)21(3)4/h5-11H,1-4H3
InChIKeyRSFCZOXPCPRHLP-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.98
Rot. Bonds2

About 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline

4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline (PubChem CID 102212163) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline.

Molecular Properties

Compound Name4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline
PubChem CID102212163
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline
SMILESCc1ccc2nc(-c3ccc(N(C)C)cc3)nc(C)c2c1
InChIInChI=1S/C18H19N3/c1-12-5-10-17-16(11-12)13(2)19-18(20-17)14-6-8-15(9-7-14)21(3)4/h5-11H,1-4H3
InChIKeyRSFCZOXPCPRHLP-UHFFFAOYSA-N
XLogP3.98
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-2-[4-(dimethylamino)phenyl]quinazolin-4-amine
CID 64983672
2-[5-[4-(dimethylamino)phenyl]-2-pyridinyl]-6-methylquinoline-4-carboxylic acid
CID 170149298
2-(4-methoxyphenyl)-6-methylquinazolin-4-amine
CID 64983774
4-N,4-N-dimethyl-1-N-(6-methyl-4-phenylquinazolin-2-yl)benzene-1,4-diamine
CID 3851416
4-[2,6-bis(4-methylphenyl)-4-pyridinyl]-N,N-dimethylaniline
CID 129140985
2-[4-(dimethylamino)phenyl]quinazoline-4-carbonitrile
CID 102339086
2-[4-[4-(dimethylamino)phenyl]-3-fluorophenyl]-6-methylquinoline-4-carbaldehyde
CID 170149113
4,6-bis[4-(dimethylamino)phenyl]-1,3,5-triazin-2-amine
CID 54222591
4-(7-bromo-4-chloroquinazolin-2-yl)-N,N-dimethylaniline
CID 114590522
7-methyl-3-(4-methylphenyl)-1,2,4-benzotriazine
CID 12759616
4,6-dimethylquinazoline-2-carboxylic acid
CID 84776717
2-(4-chlorophenyl)-N-ethyl-6-methylquinazolin-4-amine
CID 64981585

Frequently Asked Questions

What is the IUPAC name of 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline?
The IUPAC name of 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline (CID 102212163) is 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline.
What is the SMILES notation for 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline?
The canonical SMILES for 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline is Cc1ccc2nc(-c3ccc(N(C)C)cc3)nc(C)c2c1.
What is the InChIKey of 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline?
The InChIKey is RSFCZOXPCPRHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-12-5-10-17-16(11-12)13(2)19-18(20-17)14-6-8-15(9-7-14)21(3)4/h5-11H,1-4H3.
What are the key properties of 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline?
4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline has a molecular weight of 277.37 g/mol, XLogP of 3.98, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,6-dimethylquinazolin-2-yl)-N,N-dimethylaniline is sourced from PubChem (CID 102212163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).