(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide

C9H18N2O — CID 142459881

IUPAC(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide
SMILESCCCN1CCC[C@@H]1C(=O)NC
InChIInChI=1S/C9H18N2O/c1-3-6-11-7-4-5-8(11)9(12)10-2/h8H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1
InChIKeyGSLAESWJBKLFOU-MRVPVSSYSA-N
MW170.26 g/mol
LogP0.61
Rot. Bonds3

About (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide

(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide (PubChem CID 142459881) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide
PubChem CID142459881
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide
SMILESCCCN1CCC[C@@H]1C(=O)NC
InChIInChI=1S/C9H18N2O/c1-3-6-11-7-4-5-8(11)9(12)10-2/h8H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1
InChIKeyGSLAESWJBKLFOU-MRVPVSSYSA-N
XLogP0.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide (CID 142459881) is (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide is CCCN1CCC[C@@H]1C(=O)NC.
What is the InChIKey of (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide?
The InChIKey is GSLAESWJBKLFOU-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-3-6-11-7-4-5-8(11)9(12)10-2/h8H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1.
What are the key properties of (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide?
(2R)-N-methyl-1-propylpyrrolidine-2-carboxamide has a molecular weight of 170.26 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-1-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 142459881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).