4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide

C14H23N3O2 — CID 106391030

IUPAC4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NCCn2cccc2)CCNCC1
InChIInChI=1S/C14H23N3O2/c1-19-12-14(4-6-15-7-5-14)13(18)16-8-11-17-9-2-3-10-17/h2-3,9-10,15H,4-8,11-12H2,1H3,(H,16,18)
InChIKeyAWHFNSZRPWDDCB-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.62
Rot. Bonds6

About 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide

4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide (PubChem CID 106391030) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide
PubChem CID106391030
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NCCn2cccc2)CCNCC1
InChIInChI=1S/C14H23N3O2/c1-19-12-14(4-6-15-7-5-14)13(18)16-8-11-17-9-2-3-10-17/h2-3,9-10,15H,4-8,11-12H2,1H3,(H,16,18)
InChIKeyAWHFNSZRPWDDCB-UHFFFAOYSA-N
XLogP0.62
TPSA55.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(methoxymethyl)-N-(2-phenoxyethyl)piperidine-4-carboxamide;hydrochloride
CID 120617692
N-[2-(2,6-dimethylphenyl)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120633424
N-ethyl-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120616337
methyl 2-[2-[[4-(methoxymethyl)piperidine-4-carbonyl]amino]ethylsulfanyl]acetate
CID 120631431
N-(2-hydroxy-2-methylpropyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 114042041
N-[2-(2,6-dichlorophenyl)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120625301
4-(methoxymethyl)-N-[2-(2-methylpiperidin-1-yl)ethyl]piperidine-4-carboxamide
CID 120642550
N-(2-ethoxyethyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120620372
4-(methoxymethyl)-N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 120633664
N-(3-anilino-3-oxopropyl)-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120632986
N-[2-(2,6-dimethylphenoxy)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120623806
N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120646176

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide?
The IUPAC name of 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide (CID 106391030) is 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide is COCC1(C(=O)NCCn2cccc2)CCNCC1.
What is the InChIKey of 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide?
The InChIKey is AWHFNSZRPWDDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-19-12-14(4-6-15-7-5-14)13(18)16-8-11-17-9-2-3-10-17/h2-3,9-10,15H,4-8,11-12H2,1H3,(H,16,18).
What are the key properties of 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide?
4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.62, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-(2-pyrrol-1-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 106391030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).