N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine

C15H22N4 — CID 116951200

IUPACN-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine
SMILESCNC(c1ccc2c(c1)ncn2C)C1CCCCN1
InChIInChI=1S/C15H22N4/c1-16-15(12-5-3-4-8-17-12)11-6-7-14-13(9-11)18-10-19(14)2/h6-7,9-10,12,15-17H,3-5,8H2,1-2H3
InChIKeyMMOTUNKWYDDADX-UHFFFAOYSA-N
MW258.37 g/mol
LogP1.98
Rot. Bonds3

About N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine

N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine (PubChem CID 116951200) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine
PubChem CID116951200
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC NameN-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine
SMILESCNC(c1ccc2c(c1)ncn2C)C1CCCCN1
InChIInChI=1S/C15H22N4/c1-16-15(12-5-3-4-8-17-12)11-6-7-14-13(9-11)18-10-19(14)2/h6-7,9-10,12,15-17H,3-5,8H2,1-2H3
InChIKeyMMOTUNKWYDDADX-UHFFFAOYSA-N
XLogP1.98
TPSA41.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(2-methyl-1,3-benzoxazol-6-yl)-1-piperidin-2-ylmethanamine
CID 116951196
1-(3-chloro-4-methoxyphenyl)-N-methyl-1-piperidin-2-ylmethanamine
CID 116951150
5-[cyclohexyl(methoxy)methyl]-1-methylbenzimidazole
CID 139905735
N-methyl-1-(6-methylnaphthalen-2-yl)-1-pyrrolidin-2-ylmethanamine
CID 116950987
2-(methylamino)-2-(1-methylbenzimidazol-5-yl)acetaldehyde
CID 116954228
N-methyl-1-(3-methylphenyl)-1-pyrrolidin-2-ylmethanamine
CID 116950968
(1R)-N-methyl-1-phenyl-1-[(2S)-pyrrolidin-2-yl]methanamine
CID 132599012
1-(3-chloro-4-fluorophenyl)-N-methyl-1-pyrrolidin-2-ylmethanamine
CID 116950939
azetidin-3-yl-(1-methylbenzimidazol-5-yl)methanamine
CID 116935373
N-methyl-1-(4-phenylphenyl)-1-pyrrolidin-2-ylmethanamine
CID 116950906
(1S)-1-(1-methylbenzimidazol-5-yl)ethanamine
CID 95992488
2-amino-3-(methylamino)-3-(1-methylbenzimidazol-5-yl)propanoic acid
CID 116957399

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine?
The IUPAC name of N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine (CID 116951200) is N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine.
What is the SMILES notation for N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine?
The canonical SMILES for N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine is CNC(c1ccc2c(c1)ncn2C)C1CCCCN1.
What is the InChIKey of N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine?
The InChIKey is MMOTUNKWYDDADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-16-15(12-5-3-4-8-17-12)11-6-7-14-13(9-11)18-10-19(14)2/h6-7,9-10,12,15-17H,3-5,8H2,1-2H3.
What are the key properties of N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine?
N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine has a molecular weight of 258.37 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylbenzimidazol-5-yl)-1-piperidin-2-ylmethanamine is sourced from PubChem (CID 116951200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).