1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide

C20H31N5O2 — CID 56870223

IUPAC1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide
SMILESO=C(NCCc1cn[nH]c1)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1
InChIInChI=1S/C20H31N5O2/c26-19(21-8-5-15-12-22-23-13-15)17-2-1-9-25(14-17)18-6-10-24(11-7-18)20(27)16-3-4-16/h12-13,16-18H,1-11,14H2,(H,21,26)(H,22,23)
InChIKeyMRFOKURVDSBYQD-UHFFFAOYSA-N
MW373.50 g/mol
LogP1.18
Rot. Bonds6

About 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide

1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide (PubChem CID 56870223) has the molecular formula C20H31N5O2 and a molecular weight of 373.50 g/mol. Its IUPAC name is 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide
PubChem CID56870223
Molecular FormulaC20H31N5O2
Molecular Weight373.50 g/mol
Exact Mass373.25
IUPAC Name1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide
SMILESO=C(NCCc1cn[nH]c1)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1
InChIInChI=1S/C20H31N5O2/c26-19(21-8-5-15-12-22-23-13-15)17-2-1-9-25(14-17)18-6-10-24(11-7-18)20(27)16-3-4-16/h12-13,16-18H,1-11,14H2,(H,21,26)(H,22,23)
InChIKeyMRFOKURVDSBYQD-UHFFFAOYSA-N
XLogP1.18
TPSA81.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide with MolForge

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Related Compounds

1-(cyclohexylmethyl)-N-methyl-6-oxo-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide
CID 24790680
1-(cyclobutylcarbonyl)-N-methyl-N-[2-(1H-pyrazol-4-yl)ethyl]-4-piperidinecarboxamide
CID 72851681
N-[2-Methyl-2-(4-methylpiperazin-1-YL)propyl]-3-(1H-pyrazol-4-YL)propanamide
CID 124206842
N-[2-[(2R)-1-cyclopentylpiperidin-2-yl]ethyl]-3-(1H-pyrazol-4-yl)propanamide
CID 125162490
N-cyclohexyl-N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)propanamide
CID 132425753
N-[1-(1H-pyrazol-4-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 136517991
N-isopropyl-1'-[4-(1H-pyrazol-4-yl)butanoyl]-1,4'-bipiperidine-4-carboxamide
CID 56744883
1'-[4-(1H-pyrazol-4-yl)butanoyl]-3-(pyrrolidin-1-ylcarbonyl)-1,4'-bipiperidine
CID 56757039
(4-methylpiperidin-1-yl)-[1-[3-(1H-pyrazol-4-yl)propyl]piperidin-3-yl]methanone
CID 71869022
1-[2-(1H-pyrazol-4-yl)ethyl]piperidine-2,6-dione
CID 118889077
(3R)-1-(1-methylpiperidin-4-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]piperidine-3-carboxamide
CID 29028689
(3S)-1-(1-methylpiperidin-4-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]piperidine-3-carboxamide
CID 29028691

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide?
The IUPAC name of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide (CID 56870223) is 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide is O=C(NCCc1cn[nH]c1)C1CCCN(C2CCN(C(=O)C3CC3)CC2)C1.
What is the InChIKey of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide?
The InChIKey is MRFOKURVDSBYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5O2/c26-19(21-8-5-15-12-22-23-13-15)17-2-1-9-25(14-17)18-6-10-24(11-7-18)20(27)16-3-4-16/h12-13,16-18H,1-11,14H2,(H,21,26)(H,22,23).
What are the key properties of 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide?
1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide has a molecular weight of 373.50 g/mol, XLogP of 1.18, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(1H-pyrazol-4-yl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 56870223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).