N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide

C10H20N2O — CID 104955184

IUPACN-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide
SMILESCCCC(=O)NCC[C@@H]1CCCN1
InChIInChI=1S/C10H20N2O/c1-2-4-10(13)12-8-6-9-5-3-7-11-9/h9,11H,2-8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKeyGLMDHISNQGORKA-VIFPVBQESA-N
MW184.28 g/mol
LogP1.04
Rot. Bonds5

About N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide

N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide (PubChem CID 104955184) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide.

Molecular Properties

Compound NameN-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide
PubChem CID104955184
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide
SMILESCCCC(=O)NCC[C@@H]1CCCN1
InChIInChI=1S/C10H20N2O/c1-2-4-10(13)12-8-6-9-5-3-7-11-9/h9,11H,2-8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKeyGLMDHISNQGORKA-VIFPVBQESA-N
XLogP1.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(2R)-pyrrolidin-2-yl]ethyl]dodecanamide
CID 104971837
N-(2-pyrrolidin-2-ylethyl)octanamide
CID 114793852
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]propanamide
CID 104955188
N-(2-piperidin-2-ylethyl)octanamide
CID 43125232
1-ethyl-3-[2-[(2R)-pyrrolidin-2-yl]ethyl]urea
CID 104972281
N-(2-pyrrolidin-2-ylethyl)pent-4-enamide
CID 114793761
3-methyl-N-(2-pyrrolidin-2-ylethyl)butanamide
CID 83619295
3,3-dimethyl-N-(2-pyrrolidin-2-ylethyl)butanamide
CID 114793955
2-ethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]butanamide
CID 104972087
5-methyl-N-(2-piperidin-2-ylethyl)hex-5-enamide
CID 144920966
1,1-diethyl-3-(2-pyrrolidin-2-ylethyl)urea
CID 114794047
N-(2-cyclohexylethyl)-3-piperidin-2-ylpropanamide
CID 62210016

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide?
The IUPAC name of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide (CID 104955184) is N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide.
What is the SMILES notation for N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide?
The canonical SMILES for N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide is CCCC(=O)NCC[C@@H]1CCCN1.
What is the InChIKey of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide?
The InChIKey is GLMDHISNQGORKA-VIFPVBQESA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-4-10(13)12-8-6-9-5-3-7-11-9/h9,11H,2-8H2,1H3,(H,12,13)/t9-/m0/s1.
What are the key properties of N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide?
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide has a molecular weight of 184.28 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2S)-pyrrolidin-2-yl]ethyl]butanamide is sourced from PubChem (CID 104955184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).