5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine

C14H21N5 — CID 72851312

IUPAC5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine
SMILESCCc1cnc(N(C)CCCc2nccn2C)nc1
InChIInChI=1S/C14H21N5/c1-4-12-10-16-14(17-11-12)19(3)8-5-6-13-15-7-9-18(13)2/h7,9-11H,4-6,8H2,1-3H3
InChIKeyVGMXUKPPIMGNJC-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.84
Rot. Bonds6

About 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine

5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine (PubChem CID 72851312) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine
PubChem CID72851312
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine
SMILESCCc1cnc(N(C)CCCc2nccn2C)nc1
InChIInChI=1S/C14H21N5/c1-4-12-10-16-14(17-11-12)19(3)8-5-6-13-15-7-9-18(13)2/h7,9-11H,4-6,8H2,1-3H3
InChIKeyVGMXUKPPIMGNJC-UHFFFAOYSA-N
XLogP1.84
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-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

2-N,5-dimethyl-2-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidine-2,4-diamine
CID 46997101
1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
CID 67392091
N,N-bis[3-(1-methylimidazol-2-yl)propyl]heptan-1-amine
CID 140833514
N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-4-amine
CID 72881255
N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]-4-pyridin-2-ylpyrimidin-2-amine
CID 74235815
1-methyl-2-nonylimidazole
CID 67393993
1-methyl-2-pentadecylimidazole
CID 68899434
1,1-dimethyl-2-[2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 114527728
2-butyl-1-methylimidazole;fluoroform
CID 162050255
alumane;2-hexyl-1-methylimidazole;tetrahydrochloride
CID 174887731
azane;1-methyl-2-propylimidazole
CID 174525892
2-[2-[methyl-[3-(1-methylimidazol-2-yl)propyl]amino]pyrimidin-4-yl]pyridine-4-carboxylic acid
CID 70736552

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine?
The IUPAC name of 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine (CID 72851312) is 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine.
What is the SMILES notation for 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine?
The canonical SMILES for 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine is CCc1cnc(N(C)CCCc2nccn2C)nc1.
What is the InChIKey of 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine?
The InChIKey is VGMXUKPPIMGNJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-12-10-16-14(17-11-12)19(3)8-5-6-13-15-7-9-18(13)2/h7,9-11H,4-6,8H2,1-3H3.
What are the key properties of 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine?
5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine has a molecular weight of 259.36 g/mol, XLogP of 1.84, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-methyl-N-[3-(1-methylimidazol-2-yl)propyl]pyrimidin-2-amine is sourced from PubChem (CID 72851312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).