(2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide

C13H26N2O — CID 91382009

IUPAC(2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide
SMILESCCC[C@H](C(=O)N(C)CCC)N1CCCC1
InChIInChI=1S/C13H26N2O/c1-4-8-12(15-10-6-7-11-15)13(16)14(3)9-5-2/h12H,4-11H2,1-3H3/t12-/m1/s1
InChIKeyOYKXNIQYJITUED-GFCCVEGCSA-N
MW226.36 g/mol
LogP2.12
Rot. Bonds6

About (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide

(2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide (PubChem CID 91382009) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide.

Molecular Properties

Compound Name(2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide
PubChem CID91382009
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name(2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide
SMILESCCC[C@H](C(=O)N(C)CCC)N1CCCC1
InChIInChI=1S/C13H26N2O/c1-4-8-12(15-10-6-7-11-15)13(16)14(3)9-5-2/h12H,4-11H2,1-3H3/t12-/m1/s1
InChIKeyOYKXNIQYJITUED-GFCCVEGCSA-N
XLogP2.12
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepan-1-yl)pentanoic acid
CID 43866463
2-(azocan-1-yl)pentanehydrazide
CID 83047792
N,2-dimethyl-N-propylbutanamide
CID 89368936
(2S)-1-phenyl-2-pyrrolidin-1-ylpentan-1-one
CID 86310958
2-cyano-N-methyl-N-(2-pyrrolidin-1-ylethyl)pentanamide
CID 63210764
(2R)-2-hydroxy-N-methyl-N-propylpropanamide
CID 130891820
1-(3-bromothiophen-2-yl)-2-pyrrolidin-1-ylpentan-1-one
CID 132533410
2-piperidin-1-ylheptanoic acid
CID 43803843
1-(4-bromophenyl)-2-pyrrolidin-1-ylpentan-1-one;hydrochloride
CID 11515769
2-pyrrolidin-1-yl-1-thiophen-2-ylpentan-1-one
CID 71721462
(2S)-2-amino-N-methyl-N-propylbutanamide
CID 79025089
2-(azocan-1-yl)butanoic acid
CID 43808973

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide?
The IUPAC name of (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide (CID 91382009) is (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide.
What is the SMILES notation for (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide?
The canonical SMILES for (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide is CCC[C@H](C(=O)N(C)CCC)N1CCCC1.
What is the InChIKey of (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide?
The InChIKey is OYKXNIQYJITUED-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-8-12(15-10-6-7-11-15)13(16)14(3)9-5-2/h12H,4-11H2,1-3H3/t12-/m1/s1.
What are the key properties of (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide?
(2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide has a molecular weight of 226.36 g/mol, XLogP of 2.12, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-N-propyl-2-pyrrolidin-1-ylpentanamide is sourced from PubChem (CID 91382009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).