5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine

C14H15N5 — CID 79753257

IUPAC5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCc1c(N)ncnc1Cc1nc2ccccc2n1C
InChIInChI=1S/C14H15N5/c1-9-11(16-8-17-14(9)15)7-13-18-10-5-3-4-6-12(10)19(13)2/h3-6,8H,7H2,1-2H3,(H2,15,16,17)
InChIKeyCLWCUCSPWDBEJC-UHFFFAOYSA-N
MW253.31 g/mol
LogP1.84
Rot. Bonds2

About 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine

5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine (PubChem CID 79753257) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine
PubChem CID79753257
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC Name5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCc1c(N)ncnc1Cc1nc2ccccc2n1C
InChIInChI=1S/C14H15N5/c1-9-11(16-8-17-14(9)15)7-13-18-10-5-3-4-6-12(10)19(13)2/h3-6,8H,7H2,1-2H3,(H2,15,16,17)
InChIKeyCLWCUCSPWDBEJC-UHFFFAOYSA-N
XLogP1.84
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-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

3-methyl-4-[(1-methylbenzimidazol-2-yl)methyl]aniline
CID 79753807
5-[(1-methylbenzimidazol-2-yl)methyl]pyrazin-2-amine
CID 79754305
5-chloro-3-[(1-methylbenzimidazol-2-yl)methyl]pyridin-2-amine
CID 79750643
2-[(1-methylbenzimidazol-2-yl)methyl]phenol
CID 14452296
2-fluoro-6-[(1-methylbenzimidazol-2-yl)methyl]aniline
CID 107602854
N-ethyl-3-[(1-methylbenzimidazol-2-yl)methyl]pyrazin-2-amine
CID 79754406
1-methyl-2-[4-(1-methylbenzimidazol-2-yl)butyl]benzimidazole
CID 171320881
2-(iodomethyl)-1-methylbenzimidazole
CID 20803299
2-(1-methylbenzimidazol-2-yl)ethanamine;dihydrochloride
CID 45075160
2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-2-ylethanamine
CID 79753296
3-(1-methylbenzimidazol-2-yl)propan-1-ol
CID 4585215
4-bromo-2-[(1-methylbenzimidazol-2-yl)methyl]-1,3-thiazole
CID 79754486

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine (CID 79753257) is 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine is Cc1c(N)ncnc1Cc1nc2ccccc2n1C.
What is the InChIKey of 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is CLWCUCSPWDBEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5/c1-9-11(16-8-17-14(9)15)7-13-18-10-5-3-4-6-12(10)19(13)2/h3-6,8H,7H2,1-2H3,(H2,15,16,17).
What are the key properties of 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine?
5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 253.31 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-[(1-methylbenzimidazol-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 79753257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).