ethane;4-methyl-6,7-dihydroquinazoline

C11H16N2 — CID 90864738

IUPACethane;4-methyl-6,7-dihydroquinazoline
SMILESCC.Cc1ncnc2c1=CCCC=2
InChIInChI=1S/C9H10N2.C2H6/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h4-6H,2-3H2,1H3;1-2H3
InChIKeyBVYLUCSLPHZHFZ-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.17
Rot. Bonds

About ethane;4-methyl-6,7-dihydroquinazoline

ethane;4-methyl-6,7-dihydroquinazoline (PubChem CID 90864738) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is ethane;4-methyl-6,7-dihydroquinazoline.

Molecular Properties

Compound Nameethane;4-methyl-6,7-dihydroquinazoline
PubChem CID90864738
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Nameethane;4-methyl-6,7-dihydroquinazoline
SMILESCC.Cc1ncnc2c1=CCCC=2
InChIInChI=1S/C9H10N2.C2H6/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h4-6H,2-3H2,1H3;1-2H3
InChIKeyBVYLUCSLPHZHFZ-UHFFFAOYSA-N
XLogP1.17
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7,8-Dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine
CID 58462768
4-methyl-8H-quinazolin-8-ide;yttrium
CID 58945777
4-methyl-5H-quinazolin-5-ide;yttrium
CID 58945779
4-Methyl-6,7-dihydroquinazoline
CID 59065946
1,3,4-Trimethyl-6,7-dihydroquinazolin-3-ium-4-ide
CID 88955268
(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine
CID 89038797
6,7-Dihydroquinazoline
CID 89701472
(4E,5E)-4-ethylidene-6-methyl-5-(2-methylprop-2-enylidene)pyrimidine
CID 90136221
Iodomethane;4-methyl-6,7-dihydroquinazoline
CID 90762040
Methanamine;4-methyl-6,7-dihydroquinazoline
CID 90872144
Fluoromethane;4-methyl-6,7-dihydroquinazoline
CID 91279701
Methylboronic acid;4-methyl-6,7-dihydroquinazoline
CID 91469651

Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-6,7-dihydroquinazoline?
The IUPAC name of ethane;4-methyl-6,7-dihydroquinazoline (CID 90864738) is ethane;4-methyl-6,7-dihydroquinazoline.
What is the SMILES notation for ethane;4-methyl-6,7-dihydroquinazoline?
The canonical SMILES for ethane;4-methyl-6,7-dihydroquinazoline is CC.Cc1ncnc2c1=CCCC=2.
What is the InChIKey of ethane;4-methyl-6,7-dihydroquinazoline?
The InChIKey is BVYLUCSLPHZHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2.C2H6/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h4-6H,2-3H2,1H3;1-2H3.
What are the key properties of ethane;4-methyl-6,7-dihydroquinazoline?
ethane;4-methyl-6,7-dihydroquinazoline has a molecular weight of 176.26 g/mol, XLogP of 1.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-6,7-dihydroquinazoline is sourced from PubChem (CID 90864738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).