1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide

C20H30N2O3 — CID 113005887

IUPAC1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide
SMILESCCCN(CCC)C(=O)C1CCN(C(=O)c2ccc(OC)cc2)CC1
InChIInChI=1S/C20H30N2O3/c1-4-12-21(13-5-2)20(24)17-10-14-22(15-11-17)19(23)16-6-8-18(25-3)9-7-16/h6-9,17H,4-5,10-15H2,1-3H3
InChIKeySQVFEZDOGODGOI-UHFFFAOYSA-N
MW346.47 g/mol
LogP3.20
Rot. Bonds7

About 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide

1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide (PubChem CID 113005887) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide
PubChem CID113005887
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC Name1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide
SMILESCCCN(CCC)C(=O)C1CCN(C(=O)c2ccc(OC)cc2)CC1
InChIInChI=1S/C20H30N2O3/c1-4-12-21(13-5-2)20(24)17-10-14-22(15-11-17)19(23)16-6-8-18(25-3)9-7-16/h6-9,17H,4-5,10-15H2,1-3H3
InChIKeySQVFEZDOGODGOI-UHFFFAOYSA-N
XLogP3.20
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorobenzoyl)-N,N-dipropylpiperidine-4-carboxamide
CID 17223883
N,N-dibutyl-1-(4-chlorobenzoyl)piperidine-4-carboxamide
CID 17119241
1-(3-bromobenzoyl)-N,N-dipropylpiperidine-4-carboxamide
CID 113005883
N,N-dipropyl-1-(pyridine-3-carbonyl)piperidine-4-carboxamide
CID 113005906
1-(4-methoxybenzoyl)-N-pentylpiperidine-4-carboxamide
CID 113005591
1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
CID 110307099
(4-methoxyphenyl)-pyrrolidin-1-yl(111C)methanone
CID 10976580
1-(4-chlorobenzoyl)-N,N-diethylpiperidine-4-carboxamide
CID 17119192
[4-(4-methoxyphenoxy)piperidin-1-yl]-(4-methoxyphenyl)methanone
CID 110396821
[1-[4-(aminomethyl)benzoyl]piperidin-4-yl]-(4-methoxyphenyl)methanone
CID 119276704
1-(2-bromobenzoyl)-N,N-dipropylpiperidine-4-carboxamide
CID 113005882
1-(3,5-dimethoxybenzoyl)-N-[(4-methoxyphenyl)methyl]-N-methylpiperidine-4-carboxamide
CID 55719859

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide?
The IUPAC name of 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide (CID 113005887) is 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide?
The canonical SMILES for 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide is CCCN(CCC)C(=O)C1CCN(C(=O)c2ccc(OC)cc2)CC1.
What is the InChIKey of 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide?
The InChIKey is SQVFEZDOGODGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3/c1-4-12-21(13-5-2)20(24)17-10-14-22(15-11-17)19(23)16-6-8-18(25-3)9-7-16/h6-9,17H,4-5,10-15H2,1-3H3.
What are the key properties of 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide?
1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide has a molecular weight of 346.47 g/mol, XLogP of 3.20, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxybenzoyl)-N,N-dipropylpiperidine-4-carboxamide is sourced from PubChem (CID 113005887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).