2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine

C15H22N4 — CID 80792804

IUPAC2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine
SMILESCCC(CC)N(C)c1nc(NC)nc2ccccc12
InChIInChI=1S/C15H22N4/c1-5-11(6-2)19(4)14-12-9-7-8-10-13(12)17-15(16-3)18-14/h7-11H,5-6H2,1-4H3,(H,16,17,18)
InChIKeyVZYNZARMAUEGSK-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.30
Rot. Bonds5

About 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine

2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine (PubChem CID 80792804) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine
PubChem CID80792804
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine
SMILESCCC(CC)N(C)c1nc(NC)nc2ccccc12
InChIInChI=1S/C15H22N4/c1-5-11(6-2)19(4)14-12-9-7-8-10-13(12)17-15(16-3)18-14/h7-11H,5-6H2,1-4H3,(H,16,17,18)
InChIKeyVZYNZARMAUEGSK-UHFFFAOYSA-N
XLogP3.30
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-methyl-4-N-pentan-3-ylquinazoline-2,4-diamine
CID 80793845
2-N,4-N-dimethyl-4-N-propylquinazoline-2,4-diamine
CID 80776135
2-N-methyl-4-N,4-N-dipropylquinazoline-2,4-diamine
CID 80764587
N-butan-2-yl-2-hydrazinyl-N-methylquinazolin-4-amine
CID 80894230
2-N-ethyl-4-N-methyl-4-N-(3-methylbutan-2-yl)quinazoline-2,4-diamine
CID 80793521
2-N,4-N-dimethyl-4-N-(4-methylphenyl)quinazoline-2,4-diamine
CID 80798383
2-[[2-(methylamino)quinazolin-4-yl]-propylamino]ethanol
CID 80795390
2-[(2-hydrazinylquinazolin-4-yl)-methylamino]propan-1-ol
CID 104557153
2-[2,2-difluoroethyl-[2-(methylamino)quinazolin-4-yl]amino]ethanol
CID 107495123
2-N,4-N-dimethyl-4-N-[(5-methylfuran-2-yl)methyl]quinazoline-2,4-diamine
CID 80776365
3-[[2-(ethylamino)quinazolin-4-yl]-methylamino]butanenitrile
CID 80828170
4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine
CID 80765400

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine?
The IUPAC name of 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine (CID 80792804) is 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine.
What is the SMILES notation for 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine?
The canonical SMILES for 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine is CCC(CC)N(C)c1nc(NC)nc2ccccc12.
What is the InChIKey of 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine?
The InChIKey is VZYNZARMAUEGSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-5-11(6-2)19(4)14-12-9-7-8-10-13(12)17-15(16-3)18-14/h7-11H,5-6H2,1-4H3,(H,16,17,18).
What are the key properties of 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine?
2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine has a molecular weight of 258.37 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine is sourced from PubChem (CID 80792804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).