N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide

C18H30N4O2 — CID 120936238

IUPACN-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCOCCC1(CNC(=O)C2(n3cccn3)CCNCC2)CCCC1
InChIInChI=1S/C18H30N4O2/c1-24-14-9-17(5-2-3-6-17)15-20-16(23)18(7-11-19-12-8-18)22-13-4-10-21-22/h4,10,13,19H,2-3,5-9,11-12,14-15H2,1H3,(H,20,23)
InChIKeyUEYMETUILMKLEB-UHFFFAOYSA-N
MW334.46 g/mol
LogP1.67
Rot. Bonds7

About N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide

N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide (PubChem CID 120936238) has the molecular formula C18H30N4O2 and a molecular weight of 334.46 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
PubChem CID120936238
Molecular FormulaC18H30N4O2
Molecular Weight334.46 g/mol
Exact Mass334.24
IUPAC NameN-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCOCCC1(CNC(=O)C2(n3cccn3)CCNCC2)CCCC1
InChIInChI=1S/C18H30N4O2/c1-24-14-9-17(5-2-3-6-17)15-20-16(23)18(7-11-19-12-8-18)22-13-4-10-21-22/h4,10,13,19H,2-3,5-9,11-12,14-15H2,1H3,(H,20,23)
InChIKeyUEYMETUILMKLEB-UHFFFAOYSA-N
XLogP1.67
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide?
The IUPAC name of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide (CID 120936238) is N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide is COCCC1(CNC(=O)C2(n3cccn3)CCNCC2)CCCC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide?
The InChIKey is UEYMETUILMKLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O2/c1-24-14-9-17(5-2-3-6-17)15-20-16(23)18(7-11-19-12-8-18)22-13-4-10-21-22/h4,10,13,19H,2-3,5-9,11-12,14-15H2,1H3,(H,20,23).
What are the key properties of N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide?
N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide has a molecular weight of 334.46 g/mol, XLogP of 1.67, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 120936238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).