(2S)-N-propan-2-ylpyrrolidine-2-carboxamide

C8H16N2O — CID 10898944

IUPAC(2S)-N-propan-2-ylpyrrolidine-2-carboxamide
SMILESCC(C)NC(=O)[C@@H]1CCCN1
InChIInChI=1S/C8H16N2O/c1-6(2)10-8(11)7-4-3-5-9-7/h6-7,9H,3-5H2,1-2H3,(H,10,11)/t7-/m0/s1
InChIKeyAUACPLOGXSJUHE-ZETCQYMHSA-N
MW156.23 g/mol
LogP0.26
Rot. Bonds2

About (2S)-N-propan-2-ylpyrrolidine-2-carboxamide

(2S)-N-propan-2-ylpyrrolidine-2-carboxamide (PubChem CID 10898944) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (2S)-N-propan-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-propan-2-ylpyrrolidine-2-carboxamide
PubChem CID10898944
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(2S)-N-propan-2-ylpyrrolidine-2-carboxamide
SMILESCC(C)NC(=O)[C@@H]1CCCN1
InChIInChI=1S/C8H16N2O/c1-6(2)10-8(11)7-4-3-5-9-7/h6-7,9H,3-5H2,1-2H3,(H,10,11)/t7-/m0/s1
InChIKeyAUACPLOGXSJUHE-ZETCQYMHSA-N
XLogP0.26
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-propan-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-propan-2-ylpyrrolidine-2-carboxamide (CID 10898944) is (2S)-N-propan-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-propan-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-propan-2-ylpyrrolidine-2-carboxamide is CC(C)NC(=O)[C@@H]1CCCN1.
What is the InChIKey of (2S)-N-propan-2-ylpyrrolidine-2-carboxamide?
The InChIKey is AUACPLOGXSJUHE-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6(2)10-8(11)7-4-3-5-9-7/h6-7,9H,3-5H2,1-2H3,(H,10,11)/t7-/m0/s1.
What are the key properties of (2S)-N-propan-2-ylpyrrolidine-2-carboxamide?
(2S)-N-propan-2-ylpyrrolidine-2-carboxamide has a molecular weight of 156.23 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-propan-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 10898944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).