5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide

C14H25N3O2 — CID 79721070

IUPAC5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide
SMILESCCCN(CC1CCNCC1)C(=O)C1CCC(=O)N1
InChIInChI=1S/C14H25N3O2/c1-2-9-17(10-11-5-7-15-8-6-11)14(19)12-3-4-13(18)16-12/h11-12,15H,2-10H2,1H3,(H,16,18)
InChIKeyYBOMQIHEFIDOHS-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.50
Rot. Bonds5

About 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide

5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide (PubChem CID 79721070) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide
PubChem CID79721070
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide
SMILESCCCN(CC1CCNCC1)C(=O)C1CCC(=O)N1
InChIInChI=1S/C14H25N3O2/c1-2-9-17(10-11-5-7-15-8-6-11)14(19)12-3-4-13(18)16-12/h11-12,15H,2-10H2,1H3,(H,16,18)
InChIKeyYBOMQIHEFIDOHS-UHFFFAOYSA-N
XLogP0.50
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-5-oxo-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide
CID 93326822
N-(piperidin-4-ylmethyl)-N-propylcyclooctanecarboxamide
CID 79702518
(2R)-5-oxo-N-propyl-N-pyrrolidin-3-ylpyrrolidine-2-carboxamide;hydrochloride
CID 119530472
2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide
CID 79721437
4-iodo-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79721151
2,2-dimethyl-N-(piperidin-4-ylmethyl)-N-propylcyclopentane-1-carboxamide
CID 107180947
N-(cyclopropylmethyl)-3-piperidin-4-yl-N-propylpropanamide
CID 62211914
3-cyclopropyl-1-(piperidin-4-ylmethyl)-1-propylurea
CID 79721029
N-(cyclopropylmethyl)-N-propylazepane-2-carboxamide
CID 64564571
4-methoxy-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702846
2,4-dioxo-N-(piperidin-4-ylmethyl)-N-propyl-1H-pyrimidine-5-carboxamide
CID 79701435
5-chloro-N-(piperidin-4-ylmethyl)-N-propylthiophene-2-carboxamide
CID 79720777

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide?
The IUPAC name of 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide (CID 79721070) is 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide?
The canonical SMILES for 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide is CCCN(CC1CCNCC1)C(=O)C1CCC(=O)N1.
What is the InChIKey of 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide?
The InChIKey is YBOMQIHEFIDOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-2-9-17(10-11-5-7-15-8-6-11)14(19)12-3-4-13(18)16-12/h11-12,15H,2-10H2,1H3,(H,16,18).
What are the key properties of 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide?
5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(piperidin-4-ylmethyl)-N-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 79721070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).