4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine

C10H18N4 — CID 152780327

IUPAC4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine
SMILESCNC1(C)N=C(N)NC2=C1CCCC2
InChIInChI=1S/C10H18N4/c1-10(12-2)7-5-3-4-6-8(7)13-9(11)14-10/h12H,3-6H2,1-2H3,(H3,11,13,14)
InChIKeyZMRJUYUZLSAPMF-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.67
Rot. Bonds1

About 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine

4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine (PubChem CID 152780327) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine.

Molecular Properties

Compound Name4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine
PubChem CID152780327
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine
SMILESCNC1(C)N=C(N)NC2=C1CCCC2
InChIInChI=1S/C10H18N4/c1-10(12-2)7-5-3-4-6-8(7)13-9(11)14-10/h12H,3-6H2,1-2H3,(H3,11,13,14)
InChIKeyZMRJUYUZLSAPMF-UHFFFAOYSA-N
XLogP0.67
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine?
The IUPAC name of 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine (CID 152780327) is 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine.
What is the SMILES notation for 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine?
The canonical SMILES for 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine is CNC1(C)N=C(N)NC2=C1CCCC2.
What is the InChIKey of 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine?
The InChIKey is ZMRJUYUZLSAPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-10(12-2)7-5-3-4-6-8(7)13-9(11)14-10/h12H,3-6H2,1-2H3,(H3,11,13,14).
What are the key properties of 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine?
4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine has a molecular weight of 194.28 g/mol, XLogP of 0.67, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-dimethyl-5,6,7,8-tetrahydro-1H-quinazoline-2,4-diamine is sourced from PubChem (CID 152780327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).