1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide

C20H25N3O3 — CID 35751247

IUPAC1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide
SMILESCN(CCNC(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1
InChIInChI=1S/C20H25N3O3/c1-22(18-5-3-2-4-6-18)13-10-21-19(24)16-7-11-23(12-8-16)20(25)17-9-14-26-15-17/h2-6,9,14-16H,7-8,10-13H2,1H3,(H,21,24)
InChIKeyHLDKCNDNJGTBLU-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.38
Rot. Bonds6

About 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide

1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide (PubChem CID 35751247) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide
PubChem CID35751247
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide
SMILESCN(CCNC(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1
InChIInChI=1S/C20H25N3O3/c1-22(18-5-3-2-4-6-18)13-10-21-19(24)16-7-11-23(12-8-16)20(25)17-9-14-26-15-17/h2-6,9,14-16H,7-8,10-13H2,1H3,(H,21,24)
InChIKeyHLDKCNDNJGTBLU-UHFFFAOYSA-N
XLogP2.38
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3,5-dimethoxybenzoyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide
CID 55719644
1-(furan-3-carbonyl)-N-(2-phenylbutyl)piperidine-4-carboxamide
CID 134048628
1-(furan-3-carbonyl)-N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide
CID 134048432
1-(3,5-dimethylbenzoyl)-N-[2-(N-methylanilino)ethyl]piperidine-3-carboxamide
CID 55789576
N-benzyl-1-(furan-3-carbonyl)-N-methylpiperidine-4-carboxamide
CID 35552274
1-(furan-3-carbonyl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 35550742
1-(furan-3-carbonyl)-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide
CID 35555974
N-[2-(3,5-dimethylphenoxy)ethyl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 51125128
1-(1,3-benzoxazol-2-yl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide
CID 24607473
N-[4-(diethylamino)phenyl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 39126265
N-[(2S)-butan-2-yl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 39992604
N-[(2R)-butan-2-yl]-1-(furan-3-carbonyl)piperidine-4-carboxamide
CID 39992601

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide (CID 35751247) is 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide is CN(CCNC(=O)C1CCN(C(=O)c2ccoc2)CC1)c1ccccc1.
What is the InChIKey of 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide?
The InChIKey is HLDKCNDNJGTBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-22(18-5-3-2-4-6-18)13-10-21-19(24)16-7-11-23(12-8-16)20(25)17-9-14-26-15-17/h2-6,9,14-16H,7-8,10-13H2,1H3,(H,21,24).
What are the key properties of 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide?
1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-carbonyl)-N-[2-(N-methylanilino)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 35751247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).