2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide

C12H20N4O2 — CID 55246640

IUPAC2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide
SMILESCCCN(C(=O)c1c[nH]c(=O)[nH]1)C1CCCNC1
InChIInChI=1S/C12H20N4O2/c1-2-6-16(9-4-3-5-13-7-9)11(17)10-8-14-12(18)15-10/h8-9,13H,2-7H2,1H3,(H2,14,15,18)
InChIKeyBSWCBJCGUQSLEV-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.31
Rot. Bonds4

About 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide

2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide (PubChem CID 55246640) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide
PubChem CID55246640
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide
SMILESCCCN(C(=O)c1c[nH]c(=O)[nH]1)C1CCCNC1
InChIInChI=1S/C12H20N4O2/c1-2-6-16(9-4-3-5-13-7-9)11(17)10-8-14-12(18)15-10/h8-9,13H,2-7H2,1H3,(H2,14,15,18)
InChIKeyBSWCBJCGUQSLEV-UHFFFAOYSA-N
XLogP0.31
TPSA80.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide (CID 55246640) is 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide is CCCN(C(=O)c1c[nH]c(=O)[nH]1)C1CCCNC1.
What is the InChIKey of 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is BSWCBJCGUQSLEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-2-6-16(9-4-3-5-13-7-9)11(17)10-8-14-12(18)15-10/h8-9,13H,2-7H2,1H3,(H2,14,15,18).
What are the key properties of 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide?
2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 0.31, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-piperidin-3-yl-N-propyl-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 55246640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).