N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine

C12H22N4 — CID 83186097

IUPACN,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine
SMILESCCNCc1cnc(N(CC)CC)nc1C
InChIInChI=1S/C12H22N4/c1-5-13-8-11-9-14-12(15-10(11)4)16(6-2)7-3/h9,13H,5-8H2,1-4H3
InChIKeyQTOSWNKQUMZYLJ-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.74
Rot. Bonds6

About N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine

N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine (PubChem CID 83186097) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine
PubChem CID83186097
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine
SMILESCCNCc1cnc(N(CC)CC)nc1C
InChIInChI=1S/C12H22N4/c1-5-13-8-11-9-14-12(15-10(11)4)16(6-2)7-3/h9,13H,5-8H2,1-4H3
InChIKeyQTOSWNKQUMZYLJ-UHFFFAOYSA-N
XLogP1.74
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine 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

5-(ethylaminomethyl)-4-methyl-N,N-dipropylpyrimidin-2-amine
CID 83186275
N'-ethyl-N'-[5-(ethylaminomethyl)-4-methylpyrimidin-2-yl]-N,N-dimethylpropane-1,3-diamine
CID 102997398
[2-(diethylamino)-4-methylpyrimidin-5-yl]methanol
CID 83183758
4-methyl-N,N-dipropyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 83186192
5-(ethylaminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine
CID 83185815
N-ethyl-4-methyl-N-phenyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 83180589
N-cyclopropyl-N-(cyclopropylmethyl)-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine
CID 83189085
N-(cyclobutylmethyl)-N-ethyl-4-methyl-5-[(2-methylpropylamino)methyl]pyrimidin-2-amine
CID 107401794
5-(ethylaminomethyl)-N-(furan-2-ylmethyl)-N,4-dimethylpyrimidin-2-amine
CID 83186463
5-(ethylaminomethyl)-N-(3-fluorophenyl)-N,4-dimethylpyrimidin-2-amine
CID 83186234
N-[(4-bromothiophen-2-yl)methyl]-5-(ethylaminomethyl)-N,4-dimethylpyrimidin-2-amine
CID 83185537
N,N-dibutyl-4-methyl-5-(methylaminomethyl)pyrimidin-2-amine
CID 83185864

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine?
The IUPAC name of N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine (CID 83186097) is N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine.
What is the SMILES notation for N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine?
The canonical SMILES for N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine is CCNCc1cnc(N(CC)CC)nc1C.
What is the InChIKey of N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine?
The InChIKey is QTOSWNKQUMZYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-5-13-8-11-9-14-12(15-10(11)4)16(6-2)7-3/h9,13H,5-8H2,1-4H3.
What are the key properties of N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine?
N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine has a molecular weight of 222.34 g/mol, XLogP of 1.74, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine is sourced from PubChem (CID 83186097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).