2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine

C15H20N4O — CID 80796036

IUPAC2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine
SMILESCNc1nc(N(C)CC2CCCO2)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c1-16-15-17-13-8-4-3-7-12(13)14(18-15)19(2)10-11-6-5-9-20-11/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,16,17,18)
InChIKeyRTXSCTNXOYRFDQ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.29
Rot. Bonds4

About 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine

2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine (PubChem CID 80796036) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine
PubChem CID80796036
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine
SMILESCNc1nc(N(C)CC2CCCO2)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c1-16-15-17-13-8-4-3-7-12(13)14(18-15)19(2)10-11-6-5-9-20-11/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,16,17,18)
InChIKeyRTXSCTNXOYRFDQ-UHFFFAOYSA-N
XLogP2.29
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[methyl(oxolan-2-ylmethyl)amino]quinazoline-2-carboxylic acid
CID 63868694
2-N,4-N-dimethyl-4-N-propylquinazoline-2,4-diamine
CID 80776135
2-N,4-N-dimethyl-4-N-(oxolan-3-yl)quinazoline-2,4-diamine
CID 82745198
5-fluoro-2-N,4-N-dimethyl-4-N-(oxan-2-ylmethyl)pyrimidine-2,4-diamine
CID 80795547
3-(bromomethyl)-N-methyl-N-(oxan-2-ylmethyl)quinolin-2-amine
CID 107081248
2-N,4-N-dimethyl-4-N-[(5-methylfuran-2-yl)methyl]quinazoline-2,4-diamine
CID 80776365
N-methyl-3-(methylaminomethyl)-N-(oxolan-2-ylmethyl)imidazo[1,2-a]pyridin-2-amine
CID 61432564
N-methyl-N-(oxan-2-ylmethyl)quinolin-2-amine
CID 133271800
N-methyl-2-(methylaminomethyl)-N-(oxolan-2-ylmethyl)aniline
CID 61431971
2-N,4-N-dimethyl-4-N-(thiolan-3-yl)quinazoline-2,4-diamine
CID 80784259
2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine
CID 80792804
2-[methyl(oxolan-2-ylmethyl)amino]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 61432285

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine?
The IUPAC name of 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine (CID 80796036) is 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine.
What is the SMILES notation for 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine?
The canonical SMILES for 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine is CNc1nc(N(C)CC2CCCO2)c2ccccc2n1.
What is the InChIKey of 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine?
The InChIKey is RTXSCTNXOYRFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-16-15-17-13-8-4-3-7-12(13)14(18-15)19(2)10-11-6-5-9-20-11/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,16,17,18).
What are the key properties of 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine?
2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine has a molecular weight of 272.35 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dimethyl-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine is sourced from PubChem (CID 80796036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).