1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide

C15H22N4O2 — CID 115620012

IUPAC1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
SMILESO=C(NCCc1ncc[nH]1)C1CCCN(C(=O)C2CC2)C1
InChIInChI=1S/C15H22N4O2/c20-14(18-6-5-13-16-7-8-17-13)12-2-1-9-19(10-12)15(21)11-3-4-11/h7-8,11-12H,1-6,9-10H2,(H,16,17)(H,18,20)
InChIKeyUELUJJCOBBJLPK-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.72
Rot. Bonds5

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

1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide (PubChem CID 115620012) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
PubChem CID115620012
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
SMILESO=C(NCCc1ncc[nH]1)C1CCCN(C(=O)C2CC2)C1
InChIInChI=1S/C15H22N4O2/c20-14(18-6-5-13-16-7-8-17-13)12-2-1-9-19(10-12)15(21)11-3-4-11/h7-8,11-12H,1-6,9-10H2,(H,16,17)(H,18,20)
InChIKeyUELUJJCOBBJLPK-UHFFFAOYSA-N
XLogP0.72
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
CID 119073659
1-(2-hydroxyethyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
CID 118772758
(3R)-1-N-cyclopentyl-3-N-(1H-imidazol-2-ylmethyl)piperidine-1,3-dicarboxamide
CID 96568857
3-[[1-(cyclopropanecarbonyl)piperidine-3-carbonyl]amino]propanoic acid
CID 43354917
(3S)-1-(4-chlorobenzoyl)-N-(1H-imidazol-2-ylmethyl)piperidine-3-carboxamide
CID 95768953
4-butyl-N-[2-(1H-imidazol-2-yl)ethyl]cyclohexane-1-carboxamide
CID 115649554
N-[2-(1H-imidazol-2-yl)ethyl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 115668365
cyclopropyl-[(3R)-3-[(2R)-2-(1H-imidazol-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone
CID 97084883
(2S)-4-[[1-(cyclopropanecarbonyl)piperidine-3-carbonyl]amino]-2-hydroxybutanoic acid
CID 107833948
4-[[1-(cyclopropanecarbonyl)piperidine-3-carbonyl]amino]-2-hydroxybutanoic acid
CID 107831751
N-(2-aminoethyl)-1-(cyclopent-3-ene-1-carbonyl)piperidine-3-carboxamide
CID 64766671
2-[[1-(cyclopropanecarbonyl)piperidine-3-carbonyl]amino]acetic acid
CID 43170581

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
The IUPAC name of 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide (CID 115620012) is 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide is O=C(NCCc1ncc[nH]1)C1CCCN(C(=O)C2CC2)C1.
What is the InChIKey of 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
The InChIKey is UELUJJCOBBJLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-14(18-6-5-13-16-7-8-17-13)12-2-1-9-19(10-12)15(21)11-3-4-11/h7-8,11-12H,1-6,9-10H2,(H,16,17)(H,18,20).
What are the key properties of 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide?
1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 115620012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).