N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide

C12H23N3O — CID 115598650

IUPACN-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide
SMILESCC1CN(C)CCC1NC(=O)N1CCCC1
InChIInChI=1S/C12H23N3O/c1-10-9-14(2)8-5-11(10)13-12(16)15-6-3-4-7-15/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyGJTCUWSWONOWEW-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.13
Rot. Bonds1

About N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide

N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide (PubChem CID 115598650) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide
PubChem CID115598650
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide
SMILESCC1CN(C)CCC1NC(=O)N1CCCC1
InChIInChI=1S/C12H23N3O/c1-10-9-14(2)8-5-11(10)13-12(16)15-6-3-4-7-15/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyGJTCUWSWONOWEW-UHFFFAOYSA-N
XLogP1.13
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide (CID 115598650) is N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide is CC1CN(C)CCC1NC(=O)N1CCCC1.
What is the InChIKey of N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide?
The InChIKey is GJTCUWSWONOWEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-10-9-14(2)8-5-11(10)13-12(16)15-6-3-4-7-15/h10-11H,3-9H2,1-2H3,(H,13,16).
What are the key properties of N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide?
N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide has a molecular weight of 225.34 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpiperidin-4-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 115598650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).