4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine

C11H19N3 — CID 163270671

IUPAC4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine
SMILESCN.Cc1ncnc2c1CCC(C)C2
InChIInChI=1S/C10H14N2.CH5N/c1-7-3-4-9-8(2)11-6-12-10(9)5-7;1-2/h6-7H,3-5H2,1-2H3;2H2,1H3
InChIKeyOXBPRFLFVXYPII-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.48
Rot. Bonds

About 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine

4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine (PubChem CID 163270671) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine.

Molecular Properties

Compound Name4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine
PubChem CID163270671
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine
SMILESCN.Cc1ncnc2c1CCC(C)C2
InChIInChI=1S/C10H14N2.CH5N/c1-7-3-4-9-8(2)11-6-12-10(9)5-7;1-2/h6-7H,3-5H2,1-2H3;2H2,1H3
InChIKeyOXBPRFLFVXYPII-UHFFFAOYSA-N
XLogP1.48
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-7-methyl-5,6,7,8-tetrahydroquinoline
CID 150264959
2-methoxy-4,7-dimethyl-5,6,7,8-tetrahydroquinazoline
CID 163270079
2,5,6,7,8-pentamethyl-1,2,3,4-tetrahydronaphthalene
CID 22888683
1-(aminodiazenyl)-6-methyl-5,6,7,8-tetrahydroisoquinoline
CID 129060155
(13S)-4,13-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
CID 919544
ethane;(7S)-7-methyl-5,6,7,8-tetrahydroquinoline
CID 143143665
(7S)-7-methyl-N-prop-2-ynyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
CID 9251872
4-(4-methylcyclohexyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 106779446
(6S)-4-chloro-6-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
CID 929976
N-(3,5-dimethylphenyl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine;hydrochloride
CID 44635802
1,6-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 130033796
(7S)-7-methyl-4-(4-methylpiperidin-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
CID 703878

Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine?
The IUPAC name of 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine (CID 163270671) is 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine.
What is the SMILES notation for 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine?
The canonical SMILES for 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine is CN.Cc1ncnc2c1CCC(C)C2.
What is the InChIKey of 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine?
The InChIKey is OXBPRFLFVXYPII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2.CH5N/c1-7-3-4-9-8(2)11-6-12-10(9)5-7;1-2/h6-7H,3-5H2,1-2H3;2H2,1H3.
What are the key properties of 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine?
4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine has a molecular weight of 193.29 g/mol, XLogP of 1.48, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-5,6,7,8-tetrahydroquinazoline;methanamine is sourced from PubChem (CID 163270671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).