4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide

C19H35N3O2 — CID 108561969

IUPAC4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(NC(=O)CCC2CCCCC2)CC1
InChIInChI=1S/C19H35N3O2/c1-3-21(4-2)19(24)22-14-12-17(13-15-22)20-18(23)11-10-16-8-6-5-7-9-16/h16-17H,3-15H2,1-2H3,(H,20,23)
InChIKeyLPNYWVYHVALABQ-UHFFFAOYSA-N
MW337.51 g/mol
LogP3.39
Rot. Bonds6

About 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide

4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide (PubChem CID 108561969) has the molecular formula C19H35N3O2 and a molecular weight of 337.51 g/mol. Its IUPAC name is 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide
PubChem CID108561969
Molecular FormulaC19H35N3O2
Molecular Weight337.51 g/mol
Exact Mass337.27
IUPAC Name4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(NC(=O)CCC2CCCCC2)CC1
InChIInChI=1S/C19H35N3O2/c1-3-21(4-2)19(24)22-14-12-17(13-15-22)20-18(23)11-10-16-8-6-5-7-9-16/h16-17H,3-15H2,1-2H3,(H,20,23)
InChIKeyLPNYWVYHVALABQ-UHFFFAOYSA-N
XLogP3.39
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.51
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclohexyl-N-(1-propanoylpiperidin-4-yl)propanamide
CID 108555732
4-(3-cyclohexylpropanoyl)-N,N-diethylpiperazine-1-carboxamide
CID 108569569
3-cyclohexyl-N-[1-(2,2-dichloroacetyl)piperidin-4-yl]propanamide
CID 108561964
N,N-diethyl-4-[(2-methoxyacetyl)amino]piperidine-1-carboxamide
CID 108562550
4-(2,2-dimethylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide
CID 3694430
3-cyclohexyl-N-[4-(methylamino)cyclohexyl]propanamide
CID 43653177
N-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]-3-methoxypropanamide
CID 108556221
3-cyclohexyl-N-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]propanamide
CID 108555663
3-cyclohexyl-N-[1-[3-(4-methylphenyl)propanoyl]piperidin-4-yl]propanamide
CID 108555735
2-chloro-N-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]propanamide
CID 108566205
3-cyclohexyl-N-[1-[2-(2-ethylphenoxy)acetyl]piperidin-4-yl]propanamide
CID 108555743
methyl N-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]carbamate
CID 108566198

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide?
The IUPAC name of 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide (CID 108561969) is 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide?
The canonical SMILES for 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide is CCN(CC)C(=O)N1CCC(NC(=O)CCC2CCCCC2)CC1.
What is the InChIKey of 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide?
The InChIKey is LPNYWVYHVALABQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35N3O2/c1-3-21(4-2)19(24)22-14-12-17(13-15-22)20-18(23)11-10-16-8-6-5-7-9-16/h16-17H,3-15H2,1-2H3,(H,20,23).
What are the key properties of 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide?
4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide has a molecular weight of 337.51 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclohexylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide is sourced from PubChem (CID 108561969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).