4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide

C19H29N3O3 — CID 651583

IUPAC4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide
SMILESCCOCCCNC(=O)C1CCN(C(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C19H29N3O3/c1-3-25-14-4-11-20-18(23)16-9-12-22(13-10-16)19(24)21-17-7-5-15(2)6-8-17/h5-8,16H,3-4,9-14H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyFJRNPGKHAQTIIO-UHFFFAOYSA-N
MW347.46 g/mol
LogP2.78
Rot. Bonds7

About 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide

4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide (PubChem CID 651583) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide
PubChem CID651583
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide
SMILESCCOCCCNC(=O)C1CCN(C(=O)Nc2ccc(C)cc2)CC1
InChIInChI=1S/C19H29N3O3/c1-3-25-14-4-11-20-18(23)16-9-12-22(13-10-16)19(24)21-17-7-5-15(2)6-8-17/h5-8,16H,3-4,9-14H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyFJRNPGKHAQTIIO-UHFFFAOYSA-N
XLogP2.78
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-N-(4-tert-butylphenyl)-4-N-(3-ethoxypropyl)piperidine-1,4-dicarboxamide
CID 86986547
1-N-(2,6-dimethylphenyl)-4-N-(3-ethoxypropyl)piperidine-1,4-dicarboxamide
CID 86987351
4-[2-(cyclobutanecarbonylamino)ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide
CID 91913288
1-[2-(4-tert-butylanilino)-2-oxoethyl]-N-(3-ethoxypropyl)piperidine-4-carboxamide
CID 55852879
1-[(4-methylphenyl)carbamothioyl]-N-pentylpiperidine-4-carboxamide
CID 43076522
4-[[[4-(3-ethoxypropylcarbamoyl)piperidine-1-carbonyl]amino]methyl]benzoic acid
CID 122019796
4-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide
CID 3571668
N-(3-ethoxypropyl)-1-[1-(4-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-4-carboxamide
CID 6497537
4-N-(3-ethoxypropyl)-1-N-[1-(2-methylphenyl)ethyl]piperidine-1,4-dicarboxamide
CID 86998780
4-N-butyl-1-N-[4-(cyclohexylcarbamoylamino)phenyl]piperidine-1,4-dicarboxamide
CID 50845870
1-(5-amino-2-methylbenzoyl)-N-(3-ethoxypropyl)piperidine-4-carboxamide
CID 120622057
N-(3-ethoxypropyl)-1-[6-(4-methylphenyl)pyrimidin-4-yl]piperidine-4-carboxamide
CID 53062132

Frequently Asked Questions

What is the IUPAC name of 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide (CID 651583) is 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide is CCOCCCNC(=O)C1CCN(C(=O)Nc2ccc(C)cc2)CC1.
What is the InChIKey of 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide?
The InChIKey is FJRNPGKHAQTIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-3-25-14-4-11-20-18(23)16-9-12-22(13-10-16)19(24)21-17-7-5-15(2)6-8-17/h5-8,16H,3-4,9-14H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide?
4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide has a molecular weight of 347.46 g/mol, XLogP of 2.78, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3-ethoxypropyl)-1-N-(4-methylphenyl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 651583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).