2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine

C17H24N4 — CID 77096975

IUPAC2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine
SMILESCc1[nH]cnc1CN1CCCCC1CCc1ccccn1
InChIInChI=1S/C17H24N4/c1-14-17(20-13-19-14)12-21-11-5-3-7-16(21)9-8-15-6-2-4-10-18-15/h2,4,6,10,13,16H,3,5,7-9,11-12H2,1H3,(H,19,20)
InChIKeyIGCRKPBXEYZZCB-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.10
Rot. Bonds5

About 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine

2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine (PubChem CID 77096975) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine.

Molecular Properties

Compound Name2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine
PubChem CID77096975
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine
SMILESCc1[nH]cnc1CN1CCCCC1CCc1ccccn1
InChIInChI=1S/C17H24N4/c1-14-17(20-13-19-14)12-21-11-5-3-7-16(21)9-8-15-6-2-4-10-18-15/h2,4,6,10,13,16H,3,5,7-9,11-12H2,1H3,(H,19,20)
InChIKeyIGCRKPBXEYZZCB-UHFFFAOYSA-N
XLogP3.10
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[(2R)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]ethyl]pyridine
CID 29214676
N,N-dimethyl-6-[2-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]ethyl]pyridin-2-amine
CID 124948158
2-[2-[1-[[5-(1H-pyrazol-5-yl)thiophen-2-yl]methyl]piperidin-2-yl]ethyl]pyridine
CID 131893488
2-[2-[(2S)-1-[2-(1H-pyrazol-4-yl)ethyl]piperidin-2-yl]ethyl]pyridine
CID 124758900
3-(2-methoxyethyl)-5-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]methyl]-1,2,4-oxadiazole
CID 124758455
2-methyl-4-[2-[(2R)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]ethyl]pyridine
CID 124942258
2-methoxy-5-[[(2R)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]methyl]benzoic acid
CID 99927710
2-[2-[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-2-yl]ethyl]pyridine
CID 91832850
[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]methanol
CID 94336697
N,N-dimethyl-3-[(2R)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]propane-1-sulfonamide
CID 124846378
1-morpholin-4-yl-2-[(2R)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]ethanone
CID 124844881
2-(2,5-dimethyl-1,3-thiazol-4-yl)-1-[2-(2-pyridin-2-ylethyl)piperidin-1-yl]ethanone
CID 91841533

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine?
The IUPAC name of 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine (CID 77096975) is 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine.
What is the SMILES notation for 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine?
The canonical SMILES for 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine is Cc1[nH]cnc1CN1CCCCC1CCc1ccccn1.
What is the InChIKey of 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine?
The InChIKey is IGCRKPBXEYZZCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-14-17(20-13-19-14)12-21-11-5-3-7-16(21)9-8-15-6-2-4-10-18-15/h2,4,6,10,13,16H,3,5,7-9,11-12H2,1H3,(H,19,20).
What are the key properties of 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine?
2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine has a molecular weight of 284.41 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-2-yl]ethyl]pyridine is sourced from PubChem (CID 77096975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).