N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide

C16H24N4O2 — CID 131896825

IUPACN-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide
SMILESO=C(NCC1CCN(C(=O)c2cnc[nH]2)CC1)C1CCCC1
InChIInChI=1S/C16H24N4O2/c21-15(13-3-1-2-4-13)18-9-12-5-7-20(8-6-12)16(22)14-10-17-11-19-14/h10-13H,1-9H2,(H,17,19)(H,18,21)
InChIKeyJJDBMEYQUHQOIU-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.57
Rot. Bonds4

About N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide

N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide (PubChem CID 131896825) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide
PubChem CID131896825
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC NameN-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide
SMILESO=C(NCC1CCN(C(=O)c2cnc[nH]2)CC1)C1CCCC1
InChIInChI=1S/C16H24N4O2/c21-15(13-3-1-2-4-13)18-9-12-5-7-20(8-6-12)16(22)14-10-17-11-19-14/h10-13H,1-9H2,(H,17,19)(H,18,21)
InChIKeyJJDBMEYQUHQOIU-UHFFFAOYSA-N
XLogP1.57
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1H-Imidazole-4-carboxylic acid {(S)-2-methyl-1-[2-(3,3,3-trifluoro-1-isopropyl-2-oxo-propylcarbamoyl)-pyrrolidine-1-carbonyl]-propyl}-amide
CID 21033975
5-N-[4-(diaminomethylideneamino)butyl]-2-N-pentyl-1H-imidazole-2,5-dicarboxamide
CID 155201791
5-N-[4-(diaminomethylideneamino)butyl]-2-N-hexyl-1H-imidazole-2,5-dicarboxamide
CID 155201882
US10022354, Example 203
CID 132070232
US11691968, Example 65
CID 167524507
US11691968, Example 87
CID 167524517
US20230271952, Example 65
CID 168678777
US20230271952, Example 87
CID 168678784
5-methyl-N-[(2-methyl-1H-imidazol-5-yl)methyl]-2-[(3S)-piperidin-3-yl]-1H-imidazole-4-carboxamide
CID 172675074
1H-imidazol-5-yl-[3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]methanone
CID 53612757
N-(4-((1H-imidazol-2-yl)amino)-4-oxobutyl)pyrazine-2-carboxamide
CID 71702138
[3-(5-methyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]-(2-propan-2-yl-1H-imidazol-5-yl)methanone
CID 72127371

Frequently Asked Questions

What is the IUPAC name of N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide?
The IUPAC name of N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide (CID 131896825) is N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide?
The canonical SMILES for N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide is O=C(NCC1CCN(C(=O)c2cnc[nH]2)CC1)C1CCCC1.
What is the InChIKey of N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide?
The InChIKey is JJDBMEYQUHQOIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c21-15(13-3-1-2-4-13)18-9-12-5-7-20(8-6-12)16(22)14-10-17-11-19-14/h10-13H,1-9H2,(H,17,19)(H,18,21).
What are the key properties of N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide?
N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide has a molecular weight of 304.39 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(1H-imidazole-5-carbonyl)piperidin-4-yl]methyl]cyclopentanecarboxamide is sourced from PubChem (CID 131896825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).