5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide

C14H24N2O2 — CID 68625483

IUPAC5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide
SMILESCC(C)N(C(=O)N1CC2CC(=O)CC2C1)C(C)C
InChIInChI=1S/C14H24N2O2/c1-9(2)16(10(3)4)14(18)15-7-11-5-13(17)6-12(11)8-15/h9-12H,5-8H2,1-4H3
InChIKeyOKRYTLMOPISKOB-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.14
Rot. Bonds2

About 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide

5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide (PubChem CID 68625483) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide
PubChem CID68625483
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide
SMILESCC(C)N(C(=O)N1CC2CC(=O)CC2C1)C(C)C
InChIInChI=1S/C14H24N2O2/c1-9(2)16(10(3)4)14(18)15-7-11-5-13(17)6-12(11)8-15/h9-12H,5-8H2,1-4H3
InChIKeyOKRYTLMOPISKOB-UHFFFAOYSA-N
XLogP2.14
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide?
The IUPAC name of 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide (CID 68625483) is 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide.
What is the SMILES notation for 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide?
The canonical SMILES for 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide is CC(C)N(C(=O)N1CC2CC(=O)CC2C1)C(C)C.
What is the InChIKey of 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide?
The InChIKey is OKRYTLMOPISKOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-9(2)16(10(3)4)14(18)15-7-11-5-13(17)6-12(11)8-15/h9-12H,5-8H2,1-4H3.
What are the key properties of 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide?
5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N,N-di(propan-2-yl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxamide is sourced from PubChem (CID 68625483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).