1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide

C12H18N2O2 — CID 47022144

IUPAC1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NCC1CC1)C1CC(=O)N(C2CC2)C1
InChIInChI=1S/C12H18N2O2/c15-11-5-9(7-14(11)10-3-4-10)12(16)13-6-8-1-2-8/h8-10H,1-7H2,(H,13,16)
InChIKeyGAYXNYCKVDXCBD-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.52
Rot. Bonds4

About 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide

1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 47022144) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID47022144
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C(NCC1CC1)C1CC(=O)N(C2CC2)C1
InChIInChI=1S/C12H18N2O2/c15-11-5-9(7-14(11)10-3-4-10)12(16)13-6-8-1-2-8/h8-10H,1-7H2,(H,13,16)
InChIKeyGAYXNYCKVDXCBD-UHFFFAOYSA-N
XLogP0.52
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide (CID 47022144) is 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide is O=C(NCC1CC1)C1CC(=O)N(C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is GAYXNYCKVDXCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c15-11-5-9(7-14(11)10-3-4-10)12(16)13-6-8-1-2-8/h8-10H,1-7H2,(H,13,16).
What are the key properties of 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide?
1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 47022144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).