N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide

C15H25N3O — CID 102892838

IUPACN-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
SMILESO=C(NC1CCN(C2CC2)C1)C1NCC2CCCC21
InChIInChI=1S/C15H25N3O/c19-15(14-13-3-1-2-10(13)8-16-14)17-11-6-7-18(9-11)12-4-5-12/h10-14,16H,1-9H2,(H,17,19)
InChIKeySSGWQKJORJDNJI-UHFFFAOYSA-N
MW263.38 g/mol
LogP0.73
Rot. Bonds3

About N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide

N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide (PubChem CID 102892838) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
PubChem CID102892838
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide
SMILESO=C(NC1CCN(C2CC2)C1)C1NCC2CCCC21
InChIInChI=1S/C15H25N3O/c19-15(14-13-3-1-2-10(13)8-16-14)17-11-6-7-18(9-11)12-4-5-12/h10-14,16H,1-9H2,(H,17,19)
InChIKeySSGWQKJORJDNJI-UHFFFAOYSA-N
XLogP0.73
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide?
The IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide (CID 102892838) is N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide?
The canonical SMILES for N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide is O=C(NC1CCN(C2CC2)C1)C1NCC2CCCC21.
What is the InChIKey of N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide?
The InChIKey is SSGWQKJORJDNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c19-15(14-13-3-1-2-10(13)8-16-14)17-11-6-7-18(9-11)12-4-5-12/h10-14,16H,1-9H2,(H,17,19).
What are the key properties of N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide?
N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpyrrolidin-3-yl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carboxamide is sourced from PubChem (CID 102892838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).