N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide

C15H26N2O — CID 11594005

IUPACN-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide
SMILESCCCN1CCCC1C(=O)NC1CC2CCC1C2
InChIInChI=1S/C15H26N2O/c1-2-7-17-8-3-4-14(17)15(18)16-13-10-11-5-6-12(13)9-11/h11-14H,2-10H2,1H3,(H,16,18)
InChIKeyOOUONKVNHOLJJJ-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.17
Rot. Bonds4

About N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide

N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide (PubChem CID 11594005) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide
PubChem CID11594005
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide
SMILESCCCN1CCCC1C(=O)NC1CC2CCC1C2
InChIInChI=1S/C15H26N2O/c1-2-7-17-8-3-4-14(17)15(18)16-13-10-11-5-6-12(13)9-11/h11-14H,2-10H2,1H3,(H,16,18)
InChIKeyOOUONKVNHOLJJJ-UHFFFAOYSA-N
XLogP2.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide (CID 11594005) is N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide is CCCN1CCCC1C(=O)NC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide?
The InChIKey is OOUONKVNHOLJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-2-7-17-8-3-4-14(17)15(18)16-13-10-11-5-6-12(13)9-11/h11-14H,2-10H2,1H3,(H,16,18).
What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide?
N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide has a molecular weight of 250.39 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanyl)-1-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 11594005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).