N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide

C11H21N3O — CID 23140489

IUPACN-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide
SMILESCCCNC(=O)N1CC(N2CCCC2)C1
InChIInChI=1S/C11H21N3O/c1-2-5-12-11(15)14-8-10(9-14)13-6-3-4-7-13/h10H,2-9H2,1H3,(H,12,15)
InChIKeyYVWGFYMZIPUJCO-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.89
Rot. Bonds3

About N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide

N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide (PubChem CID 23140489) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide.

Molecular Properties

Compound NameN-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide
PubChem CID23140489
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide
SMILESCCCNC(=O)N1CC(N2CCCC2)C1
InChIInChI=1S/C11H21N3O/c1-2-5-12-11(15)14-8-10(9-14)13-6-3-4-7-13/h10H,2-9H2,1H3,(H,12,15)
InChIKeyYVWGFYMZIPUJCO-UHFFFAOYSA-N
XLogP0.89
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide?
The IUPAC name of N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide (CID 23140489) is N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide.
What is the SMILES notation for N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide?
The canonical SMILES for N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide is CCCNC(=O)N1CC(N2CCCC2)C1.
What is the InChIKey of N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide?
The InChIKey is YVWGFYMZIPUJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-2-5-12-11(15)14-8-10(9-14)13-6-3-4-7-13/h10H,2-9H2,1H3,(H,12,15).
What are the key properties of N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide?
N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide has a molecular weight of 211.31 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-pyrrolidin-1-ylazetidine-1-carboxamide is sourced from PubChem (CID 23140489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).