N-cyclohexyl-3-propylpyrrolidine-3-carboxamide

C14H26N2O — CID 55164551

IUPACN-cyclohexyl-3-propylpyrrolidine-3-carboxamide
SMILESCCCC1(C(=O)NC2CCCCC2)CCNC1
InChIInChI=1S/C14H26N2O/c1-2-8-14(9-10-15-11-14)13(17)16-12-6-4-3-5-7-12/h12,15H,2-11H2,1H3,(H,16,17)
InChIKeyTZMJNPVXZWOGGK-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.22
Rot. Bonds4

About N-cyclohexyl-3-propylpyrrolidine-3-carboxamide

N-cyclohexyl-3-propylpyrrolidine-3-carboxamide (PubChem CID 55164551) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-cyclohexyl-3-propylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-3-propylpyrrolidine-3-carboxamide
PubChem CID55164551
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-cyclohexyl-3-propylpyrrolidine-3-carboxamide
SMILESCCCC1(C(=O)NC2CCCCC2)CCNC1
InChIInChI=1S/C14H26N2O/c1-2-8-14(9-10-15-11-14)13(17)16-12-6-4-3-5-7-12/h12,15H,2-11H2,1H3,(H,16,17)
InChIKeyTZMJNPVXZWOGGK-UHFFFAOYSA-N
XLogP2.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-propylpyrrolidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-3-propylpyrrolidine-3-carboxamide (CID 55164551) is N-cyclohexyl-3-propylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-3-propylpyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-3-propylpyrrolidine-3-carboxamide is CCCC1(C(=O)NC2CCCCC2)CCNC1.
What is the InChIKey of N-cyclohexyl-3-propylpyrrolidine-3-carboxamide?
The InChIKey is TZMJNPVXZWOGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-8-14(9-10-15-11-14)13(17)16-12-6-4-3-5-7-12/h12,15H,2-11H2,1H3,(H,16,17).
What are the key properties of N-cyclohexyl-3-propylpyrrolidine-3-carboxamide?
N-cyclohexyl-3-propylpyrrolidine-3-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-propylpyrrolidine-3-carboxamide is sourced from PubChem (CID 55164551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).