N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine

C15H22N4 — CID 114789510

IUPACN'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine
SMILESCCN(CC(C)(C)CN)c1ncc2ccccc2n1
InChIInChI=1S/C15H22N4/c1-4-19(11-15(2,3)10-16)14-17-9-12-7-5-6-8-13(12)18-14/h5-9H,4,10-11,16H2,1-3H3
InChIKeyLJVPYLLIMCLFGE-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.44
Rot. Bonds5

About N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine

N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine (PubChem CID 114789510) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine
PubChem CID114789510
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC NameN'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine
SMILESCCN(CC(C)(C)CN)c1ncc2ccccc2n1
InChIInChI=1S/C15H22N4/c1-4-19(11-15(2,3)10-16)14-17-9-12-7-5-6-8-13(12)18-14/h5-9H,4,10-11,16H2,1-3H3
InChIKeyLJVPYLLIMCLFGE-UHFFFAOYSA-N
XLogP2.44
TPSA55.04 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 ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-ethyl-N'-quinazolin-2-ylpropane-1,3-diamine
CID 114788666
N'-propyl-N'-quinazolin-2-ylpropane-1,3-diamine
CID 114788667
2-[(3-amino-2,2-dimethylpropyl)-ethylamino]quinoline-3-carbonitrile
CID 79665644
3-[ethyl(quinazolin-2-yl)amino]-2-methylpropanenitrile
CID 114788703
4-[(3-amino-2,2-dimethylpropyl)-ethylamino]quinoline-3-carbonitrile
CID 79665670
3-[ethyl(quinazolin-2-yl)amino]-2-methylpropanimidamide
CID 114788799
N'-propan-2-yl-N'-quinazolin-2-ylpropane-1,3-diamine
CID 114788668
N-(3-amino-2,2-dimethylpropyl)-N-ethylquinoline-2-carboxamide
CID 79663389
N-ethyl-N-(piperidin-2-ylmethyl)quinazolin-2-amine
CID 106641730
N'-ethyl-N'-(3-fluoro-2-pyridinyl)-2,2-dimethylpropane-1,3-diamine
CID 79661860
N',2,2-trimethyl-N'-quinoxalin-2-ylpropane-1,3-diamine
CID 79652289
N-(2-chloroethyl)-N-methylquinazolin-2-amine
CID 114789805

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine?
The IUPAC name of N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine (CID 114789510) is N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine.
What is the SMILES notation for N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine?
The canonical SMILES for N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine is CCN(CC(C)(C)CN)c1ncc2ccccc2n1.
What is the InChIKey of N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine?
The InChIKey is LJVPYLLIMCLFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-4-19(11-15(2,3)10-16)14-17-9-12-7-5-6-8-13(12)18-14/h5-9H,4,10-11,16H2,1-3H3.
What are the key properties of N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine?
N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine has a molecular weight of 258.37 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-2,2-dimethyl-N'-quinazolin-2-ylpropane-1,3-diamine is sourced from PubChem (CID 114789510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).