4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one

C10H14N4O — CID 123610861

IUPAC4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one
SMILESC/N=C1\CC(C)Cc2c(N)nc(=O)[nH]c21
InChIInChI=1S/C10H14N4O/c1-5-3-6-8(7(4-5)12-2)13-10(15)14-9(6)11/h5H,3-4H2,1-2H3,(H3,11,13,14,15)/b12-7+
InChIKeySRYBAIMDXUXGCB-KPKJPENVSA-N
MW206.25 g/mol
LogP0.35
Rot. Bonds

About 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one

4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one (PubChem CID 123610861) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one.

Molecular Properties

Compound Name4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one
PubChem CID123610861
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one
SMILESC/N=C1\CC(C)Cc2c(N)nc(=O)[nH]c21
InChIInChI=1S/C10H14N4O/c1-5-3-6-8(7(4-5)12-2)13-10(15)14-9(6)11/h5H,3-4H2,1-2H3,(H3,11,13,14,15)/b12-7+
InChIKeySRYBAIMDXUXGCB-KPKJPENVSA-N
XLogP0.35
TPSA84.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one?
The IUPAC name of 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one (CID 123610861) is 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one.
What is the SMILES notation for 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one?
The canonical SMILES for 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one is C/N=C1\CC(C)Cc2c(N)nc(=O)[nH]c21.
What is the InChIKey of 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one?
The InChIKey is SRYBAIMDXUXGCB-KPKJPENVSA-N. The full InChI is InChI=1S/C10H14N4O/c1-5-3-6-8(7(4-5)12-2)13-10(15)14-9(6)11/h5H,3-4H2,1-2H3,(H3,11,13,14,15)/b12-7+.
What are the key properties of 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one?
4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one has a molecular weight of 206.25 g/mol, XLogP of 0.35, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-methyl-8-methylimino-1,5,6,7-tetrahydroquinazolin-2-one is sourced from PubChem (CID 123610861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).