N-pyrrolidin-3-ylpropanamide

C7H14N2O — CID 18337238

IUPACN-pyrrolidin-3-ylpropanamide
SMILESCCC(=O)NC1CCNC1
InChIInChI=1S/C7H14N2O/c1-2-7(10)9-6-3-4-8-5-6/h6,8H,2-5H2,1H3,(H,9,10)
InChIKeyJTOGNXBWLDRNON-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.13
Rot. Bonds2

About N-pyrrolidin-3-ylpropanamide

N-pyrrolidin-3-ylpropanamide (PubChem CID 18337238) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-pyrrolidin-3-ylpropanamide.

Molecular Properties

Compound NameN-pyrrolidin-3-ylpropanamide
PubChem CID18337238
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-pyrrolidin-3-ylpropanamide
SMILESCCC(=O)NC1CCNC1
InChIInChI=1S/C7H14N2O/c1-2-7(10)9-6-3-4-8-5-6/h6,8H,2-5H2,1H3,(H,9,10)
InChIKeyJTOGNXBWLDRNON-UHFFFAOYSA-N
XLogP-0.13
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

acetylene;propane;N-[(3S)-pyrrolidin-3-yl]propanamide
CID 143542096
N-piperidin-3-ylpropanamide
CID 3520588
2-ethoxy-N-[(3R)-pyrrolidin-3-yl]acetamide
CID 79685871
N-[(3S)-pyrrolidin-3-yl]decanamide
CID 79688087
1-pyrrolidin-3-yl-3-[(3R)-pyrrolidin-3-yl]urea
CID 66630468
ethane;N-[4-(propanoylamino)cyclohexyl]propanamide
CID 144871719
2-cyclobutyl-N-[(3R)-pyrrolidin-3-yl]acetamide
CID 103165051
ethyl N-pyrrolidin-3-ylcarbamate
CID 11321104
2-cyclopentyl-N-pyrrolidin-3-ylacetamide
CID 60778008
3-butylsulfanyl-N-pyrrolidin-3-ylpropanamide
CID 119454357
N'-propan-2-yl-N-pyrrolidin-3-ylpentanediamide;hydrochloride
CID 119451129
ethyl N-[(3R)-pyrrolidin-3-yl]carbamate;hydrochloride
CID 118918439

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-ylpropanamide?
The IUPAC name of N-pyrrolidin-3-ylpropanamide (CID 18337238) is N-pyrrolidin-3-ylpropanamide.
What is the SMILES notation for N-pyrrolidin-3-ylpropanamide?
The canonical SMILES for N-pyrrolidin-3-ylpropanamide is CCC(=O)NC1CCNC1.
What is the InChIKey of N-pyrrolidin-3-ylpropanamide?
The InChIKey is JTOGNXBWLDRNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-2-7(10)9-6-3-4-8-5-6/h6,8H,2-5H2,1H3,(H,9,10).
What are the key properties of N-pyrrolidin-3-ylpropanamide?
N-pyrrolidin-3-ylpropanamide has a molecular weight of 142.20 g/mol, XLogP of -0.13, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-ylpropanamide is sourced from PubChem (CID 18337238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).