N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine

C15H17N5 — CID 79750104

IUPACN-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine
SMILESCNC(Cc1nc2ccccc2n1C)c1ccncn1
InChIInChI=1S/C15H17N5/c1-16-13(11-7-8-17-10-18-11)9-15-19-12-5-3-4-6-14(12)20(15)2/h3-8,10,13,16H,9H2,1-2H3
InChIKeyXMYDNKHDFSBDCA-UHFFFAOYSA-N
MW267.34 g/mol
LogP1.87
Rot. Bonds4

About N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine

N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine (PubChem CID 79750104) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine
PubChem CID79750104
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC NameN-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine
SMILESCNC(Cc1nc2ccccc2n1C)c1ccncn1
InChIInChI=1S/C15H17N5/c1-16-13(11-7-8-17-10-18-11)9-15-19-12-5-3-4-6-14(12)20(15)2/h3-8,10,13,16H,9H2,1-2H3
InChIKeyXMYDNKHDFSBDCA-UHFFFAOYSA-N
XLogP1.87
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine 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

N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530552
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(4-methyl-3-pyridinyl)ethanamine
CID 114878188
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanamine
CID 105164834
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanamine
CID 82896332
1-(furan-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine
CID 79750479
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 79750179
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine
CID 79756296
N,4-dimethyl-1-(1-methylbenzimidazol-2-yl)pentan-2-amine
CID 79754110
1-(2-bromofuran-3-yl)-N-methyl-2-(1-methylbenzimidazol-2-yl)ethanamine
CID 106858090
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-(thiadiazol-5-yl)ethanamine
CID 105164915
N,5-dimethyl-1-(1-methylbenzimidazol-2-yl)hexan-2-amine
CID 79750546
N,4,4-trimethyl-1-(1-methylbenzimidazol-2-yl)pentan-2-amine
CID 79750625

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine?
The IUPAC name of N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine (CID 79750104) is N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine.
What is the SMILES notation for N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine?
The canonical SMILES for N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine is CNC(Cc1nc2ccccc2n1C)c1ccncn1.
What is the InChIKey of N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine?
The InChIKey is XMYDNKHDFSBDCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-16-13(11-7-8-17-10-18-11)9-15-19-12-5-3-4-6-14(12)20(15)2/h3-8,10,13,16H,9H2,1-2H3.
What are the key properties of N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine?
N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine has a molecular weight of 267.34 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methylbenzimidazol-2-yl)-1-pyrimidin-4-ylethanamine is sourced from PubChem (CID 79750104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).