1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine

C9H15N3 — CID 142625788

IUPAC1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine
SMILESCN1CN=C(N)C2=C1CCCC2
InChIInChI=1S/C9H15N3/c1-12-6-11-9(10)7-4-2-3-5-8(7)12/h2-6H2,1H3,(H2,10,11)
InChIKeyRTJLGAZHIYRRDX-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.07
Rot. Bonds

About 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine

1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine (PubChem CID 142625788) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine.

Molecular Properties

Compound Name1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine
PubChem CID142625788
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine
SMILESCN1CN=C(N)C2=C1CCCC2
InChIInChI=1S/C9H15N3/c1-12-6-11-9(10)7-4-2-3-5-8(7)12/h2-6H2,1H3,(H2,10,11)
InChIKeyRTJLGAZHIYRRDX-UHFFFAOYSA-N
XLogP1.07
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Amino-1-methyl-5,6,7,8-tetrahydroquinazoline-2-thione
CID 19937348
4-amino-1-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2-thione
CID 19937352
2-methylidene-5,6,7,8-tetrahydro-1H-quinazolin-4-amine
CID 59862513
2-amino-N'-methylcyclohexene-1-carboximidamide
CID 132183381
1,2,5,6,7,8-Hexahydroquinazoline-2,4-diamine
CID 141687374
1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-2-amine
CID 142625786
5,6,7,8-tetrahydro-2H-quinazoline-1,4-diamine
CID 142625789
N,3-dimethyl-5,6,7,8-tetrahydroquinazolin-4-imine
CID 54589513

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine?
The IUPAC name of 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine (CID 142625788) is 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine.
What is the SMILES notation for 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine?
The canonical SMILES for 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine is CN1CN=C(N)C2=C1CCCC2.
What is the InChIKey of 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine?
The InChIKey is RTJLGAZHIYRRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-12-6-11-9(10)7-4-2-3-5-8(7)12/h2-6H2,1H3,(H2,10,11).
What are the key properties of 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine?
1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine has a molecular weight of 165.24 g/mol, XLogP of 1.07, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5,6,7,8-tetrahydro-2H-quinazolin-4-amine is sourced from PubChem (CID 142625788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).