N-butyl-2-pyrrolidin-1-ylacetamide

C10H20N2O — CID 110687965

IUPACN-butyl-2-pyrrolidin-1-ylacetamide
SMILESCCCCNC(=O)CN1CCCC1
InChIInChI=1S/C10H20N2O/c1-2-3-6-11-10(13)9-12-7-4-5-8-12/h2-9H2,1H3,(H,11,13)
InChIKeyABXHUHQJSFHONK-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.00
Rot. Bonds5

About N-butyl-2-pyrrolidin-1-ylacetamide

N-butyl-2-pyrrolidin-1-ylacetamide (PubChem CID 110687965) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-butyl-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-butyl-2-pyrrolidin-1-ylacetamide
PubChem CID110687965
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-butyl-2-pyrrolidin-1-ylacetamide
SMILESCCCCNC(=O)CN1CCCC1
InChIInChI=1S/C10H20N2O/c1-2-3-6-11-10(13)9-12-7-4-5-8-12/h2-9H2,1H3,(H,11,13)
InChIKeyABXHUHQJSFHONK-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-dodecyl-2-pyrrolidin-1-ylacetamide
CID 11971610
2-(azepan-1-yl)-N-pentylacetamide
CID 109006030
N-dodecyl-2-piperidin-1-ylacetamide
CID 3064220
N-propyl-2-pyrrolidin-1-ylacetamide
CID 22117904
2-(4-acetylpiperazin-1-yl)-N-butylacetamide
CID 108993129
2-[4-(3-aminopropyl)-1,4-diazepan-1-yl]-N-butylacetamide
CID 61485839
2-(4-ethylpiperazin-1-yl)-N-pentylacetamide
CID 108995511
ethyl 1-[2-(butylamino)-2-oxoethyl]piperidine-4-carboxylate
CID 54837933
ethane;N-ethyl-2-pyrrolidin-1-ylacetamide
CID 144584816
2-(4-methylpiperidin-1-yl)-N-pentylacetamide
CID 108993711
N-butyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 63847877
N-heptyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
CID 22272726

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-butyl-2-pyrrolidin-1-ylacetamide (CID 110687965) is N-butyl-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-butyl-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-butyl-2-pyrrolidin-1-ylacetamide is CCCCNC(=O)CN1CCCC1.
What is the InChIKey of N-butyl-2-pyrrolidin-1-ylacetamide?
The InChIKey is ABXHUHQJSFHONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-3-6-11-10(13)9-12-7-4-5-8-12/h2-9H2,1H3,(H,11,13).
What are the key properties of N-butyl-2-pyrrolidin-1-ylacetamide?
N-butyl-2-pyrrolidin-1-ylacetamide has a molecular weight of 184.28 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 110687965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).