N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine

C11H16N4 — CID 150762634

IUPACN'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine
SMILESCN1C=c2ccccc2=NC1NCCN
InChIInChI=1S/C11H16N4/c1-15-8-9-4-2-3-5-10(9)14-11(15)13-7-6-12/h2-5,8,11,13H,6-7,12H2,1H3
InChIKeyJYDOZOWJZDCMPN-UHFFFAOYSA-N
MW204.28 g/mol
LogP-1.18
Rot. Bonds3

About N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine

N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine (PubChem CID 150762634) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine
PubChem CID150762634
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC NameN'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine
SMILESCN1C=c2ccccc2=NC1NCCN
InChIInChI=1S/C11H16N4/c1-15-8-9-4-2-3-5-10(9)14-11(15)13-7-6-12/h2-5,8,11,13H,6-7,12H2,1H3
InChIKeyJYDOZOWJZDCMPN-UHFFFAOYSA-N
XLogP-1.18
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-imidazolidin-2-ylcyclohexa-2,4-dien-1-imine
CID 68779186
1-N-(4,4a-dihydroquinoxalin-2-yl)-3-methylbutane-1,2-diamine
CID 132195633
2-(3-Methylpiperazin-1-yl)-1,8a-dihydroquinoxaline
CID 132195888
5-Amino-8-methyl-2,3-dihydroimidazo[1,2-c]quinazoline
CID 155363453
1-[(2S)-3-cyclopropyl-5-methyl-2H-quinazolin-2-yl]propan-1-amine
CID 174879498
3-deuterio-2H-quinazoline
CID 175982899
N'-[(Z)-(6-iminocyclohexa-2,4-dien-1-ylidene)-(methylideneamino)methyl]-N,N,N'-trimethylethane-1,2-diamine
CID 143956371
5-Amino-9-methyl-2,3-dihydroimidazo[1,2-c]quinazoline
CID 171372899

Frequently Asked Questions

What is the IUPAC name of N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine?
The IUPAC name of N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine (CID 150762634) is N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine is CN1C=c2ccccc2=NC1NCCN.
What is the InChIKey of N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine?
The InChIKey is JYDOZOWJZDCMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-15-8-9-4-2-3-5-10(9)14-11(15)13-7-6-12/h2-5,8,11,13H,6-7,12H2,1H3.
What are the key properties of N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine?
N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine has a molecular weight of 204.28 g/mol, XLogP of -1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-methyl-2H-quinazolin-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 150762634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).