N-pyrrolidin-1-ylpyrrolidine-1-carboxamide

C9H17N3O — CID 130685357

IUPACN-pyrrolidin-1-ylpyrrolidine-1-carboxamide
SMILESO=C(NN1CCCC1)N1CCCC1
InChIInChI=1S/C9H17N3O/c13-9(11-5-1-2-6-11)10-12-7-3-4-8-12/h1-8H2,(H,10,13)
InChIKeyUCWQXJDFKZJGCY-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.80
Rot. Bonds1

About N-pyrrolidin-1-ylpyrrolidine-1-carboxamide

N-pyrrolidin-1-ylpyrrolidine-1-carboxamide (PubChem CID 130685357) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is N-pyrrolidin-1-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-pyrrolidin-1-ylpyrrolidine-1-carboxamide
PubChem CID130685357
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC NameN-pyrrolidin-1-ylpyrrolidine-1-carboxamide
SMILESO=C(NN1CCCC1)N1CCCC1
InChIInChI=1S/C9H17N3O/c13-9(11-5-1-2-6-11)10-12-7-3-4-8-12/h1-8H2,(H,10,13)
InChIKeyUCWQXJDFKZJGCY-UHFFFAOYSA-N
XLogP0.80
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylpiperazin-1-yl)piperidine-1-carboxamide
CID 116657327
(3R)-1-(piperidin-1-ylcarbamoyl)piperidine-3-carboxylic acid
CID 83020304
1,3-dipyrrolidin-1-ylurea
CID 140976479
N-morpholin-4-ylmorpholine-4-carboxamide
CID 116657345
N-pyrrolidin-1-ylacetamide
CID 22023174
pyrrolidin-1-ylurea;hydrate
CID 141393036
N-[(piperidine-1-carbonylamino)methyl]piperidine-1-carboxamide
CID 59031008
1-(piperidin-1-ylcarbamoyl)-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 83017337
2-[4-[(4-methylpiperazin-1-yl)carbamoyl]-1,4-diazepan-1-yl]acetic acid
CID 83018037
N-(2-fluoroethyl)piperidine-1-carboxamide
CID 126973652
N-(3-hydroxy-2,3-dimethylbutan-2-yl)pyrrolidine-1-carboxamide
CID 104594555
N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 113221674

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-1-ylpyrrolidine-1-carboxamide?
The IUPAC name of N-pyrrolidin-1-ylpyrrolidine-1-carboxamide (CID 130685357) is N-pyrrolidin-1-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for N-pyrrolidin-1-ylpyrrolidine-1-carboxamide?
The canonical SMILES for N-pyrrolidin-1-ylpyrrolidine-1-carboxamide is O=C(NN1CCCC1)N1CCCC1.
What is the InChIKey of N-pyrrolidin-1-ylpyrrolidine-1-carboxamide?
The InChIKey is UCWQXJDFKZJGCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c13-9(11-5-1-2-6-11)10-12-7-3-4-8-12/h1-8H2,(H,10,13).
What are the key properties of N-pyrrolidin-1-ylpyrrolidine-1-carboxamide?
N-pyrrolidin-1-ylpyrrolidine-1-carboxamide has a molecular weight of 183.25 g/mol, XLogP of 0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-1-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 130685357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).