N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine

C17H20N4 — CID 79755294

IUPACN-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine
SMILESCCCn1c(Cc2cccc(NC)n2)nc2ccccc21
InChIInChI=1S/C17H20N4/c1-3-11-21-15-9-5-4-8-14(15)20-17(21)12-13-7-6-10-16(18-2)19-13/h4-10H,3,11-12H2,1-2H3,(H,18,19)
InChIKeyAVSDXYRZRZLXDM-UHFFFAOYSA-N
MW280.38 g/mol
LogP3.47
Rot. Bonds5

About N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine

N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine (PubChem CID 79755294) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine
PubChem CID79755294
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC NameN-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine
SMILESCCCn1c(Cc2cccc(NC)n2)nc2ccccc21
InChIInChI=1S/C17H20N4/c1-3-11-21-15-9-5-4-8-14(15)20-17(21)12-13-7-6-10-16(18-2)19-13/h4-10H,3,11-12H2,1-2H3,(H,18,19)
InChIKeyAVSDXYRZRZLXDM-UHFFFAOYSA-N
XLogP3.47
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridazin-3-amine
CID 79755479
1-propyl-2-[(1-propylbenzimidazol-2-yl)methyl]benzimidazole
CID 102471082
N-methyl-3-[(1-propylbenzimidazol-2-yl)methyl]aniline
CID 106505787
N-methyl-2-[(1-propylbenzimidazol-2-yl)methyl]pyridin-4-amine
CID 102824874
1-propyl-2-[(1-propylbenzimidazol-2-yl)methoxymethyl]benzimidazole
CID 11302951
[5-[(1-propylbenzimidazol-2-yl)methyl]thiophen-2-yl]methanamine
CID 79753969
2-[(2-chloro-6-methylpyrimidin-4-yl)methyl]-1-propylbenzimidazole
CID 79754826
N-methyl-4-(1-propylbenzimidazol-2-yl)butan-1-amine
CID 79750802
2-[(4-fluoro-2-pyridinyl)methyl]-1-propylbenzimidazole
CID 102824508
2-(2-phenylethyl)-1-propylbenzimidazole
CID 969694
trifluoro-[(1-propylbenzimidazol-2-yl)methyl]boranuide
CID 79753961
2-[(1-propylbenzimidazol-2-yl)methylamino]ethanol
CID 54905664

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine?
The IUPAC name of N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine (CID 79755294) is N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine is CCCn1c(Cc2cccc(NC)n2)nc2ccccc21.
What is the InChIKey of N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine?
The InChIKey is AVSDXYRZRZLXDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c1-3-11-21-15-9-5-4-8-14(15)20-17(21)12-13-7-6-10-16(18-2)19-13/h4-10H,3,11-12H2,1-2H3,(H,18,19).
What are the key properties of N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine?
N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine has a molecular weight of 280.38 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[(1-propylbenzimidazol-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 79755294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).