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

C11H19N3 — CID 3405601

IUPAC4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine
SMILESCC1CCC2=C(C1)NC(N)=NC2(C)C
InChIInChI=1S/C11H19N3/c1-7-4-5-8-9(6-7)13-10(12)14-11(8,2)3/h7H,4-6H2,1-3H3,(H3,12,13,14)
InChIKeySPUGLGDYNRODMZ-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.76
Rot. Bonds

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

4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine (PubChem CID 3405601) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine.

Molecular Properties

Compound Name4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine
PubChem CID3405601
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine
SMILESCC1CCC2=C(C1)NC(N)=NC2(C)C
InChIInChI=1S/C11H19N3/c1-7-4-5-8-9(6-7)13-10(12)14-11(8,2)3/h7H,4-6H2,1-3H3,(H3,12,13,14)
InChIKeySPUGLGDYNRODMZ-UHFFFAOYSA-N
XLogP1.76
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Netamine E
CID 16085295
4,4-dimethyl-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinimine
CID 12265196
1',5',6',7'-Tetrahydrospiro[cyclopentan-1,4'-cyclopentapyrimidin]-2'(3' H)-imine
CID 12265200
(7R)-4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine
CID 21793391
CID 135014316
CID 135014316
(7S)-4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine
CID 341001
(1R,4R,9R,10S)-9-butyl-10-methyl-5,7-diazatricyclo[6.3.1.04,12]dodeca-5,8(12)-dien-6-amine
CID 10848112
N,3,7,8-tetramethyl-3,4,5,5a,6,9-hexahydro-1H-pyrido[2,3-b][1,8]naphthyridin-2-imine
CID 137100475
3a,4,5,6,6a,7,8,9-octahydro-1H-perimidin-2-amine
CID 138509882
4-cyclohexyl-5,6-dimethyl-1H-pyrimidine-2,4-diamine
CID 154187063
4-Pentan-3-yl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidine-2,4-diamine
CID 154226338
4-methyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine
CID 154271660

Frequently Asked Questions

What is the IUPAC name of 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine?
The IUPAC name of 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine (CID 3405601) is 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine.
What is the SMILES notation for 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine?
The canonical SMILES for 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine is CC1CCC2=C(C1)NC(N)=NC2(C)C.
What is the InChIKey of 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine?
The InChIKey is SPUGLGDYNRODMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-7-4-5-8-9(6-7)13-10(12)14-11(8,2)3/h7H,4-6H2,1-3H3,(H3,12,13,14).
What are the key properties of 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine?
4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine has a molecular weight of 193.29 g/mol, XLogP of 1.76, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,7-trimethyl-5,6,7,8-tetrahydro-1H-quinazolin-2-amine is sourced from PubChem (CID 3405601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).