N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine

C11H20N4 — CID 106635288

IUPACN-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine
SMILESCN(Cc1cnc[nH]1)CC1CCCCN1
InChIInChI=1S/C11H20N4/c1-15(8-11-6-12-9-14-11)7-10-4-2-3-5-13-10/h6,9-10,13H,2-5,7-8H2,1H3,(H,12,14)
InChIKeyIPDDWCOPUFWBBO-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.98
Rot. Bonds4

About N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine

N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine (PubChem CID 106635288) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine.

Molecular Properties

Compound NameN-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine
PubChem CID106635288
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine
SMILESCN(Cc1cnc[nH]1)CC1CCCCN1
InChIInChI=1S/C11H20N4/c1-15(8-11-6-12-9-14-11)7-10-4-2-3-5-13-10/h6,9-10,13H,2-5,7-8H2,1H3,(H,12,14)
InChIKeyIPDDWCOPUFWBBO-UHFFFAOYSA-N
XLogP0.98
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-piperidin-2-yl-N-(1,3-thiazol-5-ylmethyl)methanamine;hydrochloride
CID 71641920
N-methyl-1-[(2R)-piperidin-2-yl]-N-(pyrazin-2-ylmethyl)methanamine
CID 97164246
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-methyl-1-piperidin-2-ylmethanamine
CID 102550778
N-methyl-1-piperidin-2-yl-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine
CID 106623020
N-[(5-chloro-1,3-thiazol-2-yl)methyl]-N-methyl-1-piperidin-2-ylmethanamine
CID 107124551
N-methyl-1-piperidin-2-yl-N-(pyrimidin-4-ylmethyl)methanamine
CID 106622951
N-[2-(1H-imidazol-5-yl)ethyl]-1-piperidin-2-ylpropan-2-amine
CID 79539364
N-methyl-N-(pyridin-4-ylmethyl)-1-pyrrolidin-2-ylmethanamine;hydrochloride
CID 71642062
N-methyl-1-piperidin-2-yl-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 103694929
N-[(2,4-dichloropyrimidin-5-yl)methyl]-N-methyl-1-[(2S)-piperidin-2-yl]methanamine
CID 97164237
N-methyl-N-(pyrrolidin-2-ylmethyl)-1H-imidazole-5-carboxamide
CID 106607277
N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine?
The IUPAC name of N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine (CID 106635288) is N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine.
What is the SMILES notation for N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine?
The canonical SMILES for N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine is CN(Cc1cnc[nH]1)CC1CCCCN1.
What is the InChIKey of N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine?
The InChIKey is IPDDWCOPUFWBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-15(8-11-6-12-9-14-11)7-10-4-2-3-5-13-10/h6,9-10,13H,2-5,7-8H2,1H3,(H,12,14).
What are the key properties of N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine?
N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine has a molecular weight of 208.31 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-5-ylmethyl)-N-methyl-1-piperidin-2-ylmethanamine is sourced from PubChem (CID 106635288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).