1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide

C12H21N3O2 — CID 43212211

IUPAC1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide
SMILESCC1CCC(C(=O)N2CCCC2C(N)=O)CN1
InChIInChI=1S/C12H21N3O2/c1-8-4-5-9(7-14-8)12(17)15-6-2-3-10(15)11(13)16/h8-10,14H,2-7H2,1H3,(H2,13,16)
InChIKeyJAXXCWKJEHHRLH-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.15
Rot. Bonds2

About 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide

1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 43212211) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide
PubChem CID43212211
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide
SMILESCC1CCC(C(=O)N2CCCC2C(N)=O)CN1
InChIInChI=1S/C12H21N3O2/c1-8-4-5-9(7-14-8)12(17)15-6-2-3-10(15)11(13)16/h8-10,14H,2-7H2,1H3,(H2,13,16)
InChIKeyJAXXCWKJEHHRLH-UHFFFAOYSA-N
XLogP-0.15
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide (CID 43212211) is 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide is CC1CCC(C(=O)N2CCCC2C(N)=O)CN1.
What is the InChIKey of 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is JAXXCWKJEHHRLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-8-4-5-9(7-14-8)12(17)15-6-2-3-10(15)11(13)16/h8-10,14H,2-7H2,1H3,(H2,13,16).
What are the key properties of 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide?
1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 239.32 g/mol, XLogP of -0.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methylpiperidine-3-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 43212211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).