5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide

C21H29N5O2 — CID 75614179

IUPAC5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide
SMILESO=C(Nc1ccc2c(ccn2CCN2CCOCC2)c1)C1CC(C2CC2)NN1
InChIInChI=1S/C21H29N5O2/c27-21(19-14-18(23-24-19)15-1-2-15)22-17-3-4-20-16(13-17)5-6-26(20)8-7-25-9-11-28-12-10-25/h3-6,13,15,18-19,23-24H,1-2,7-12,14H2,(H,22,27)
InChIKeyJOLLJADBMNQYAN-UHFFFAOYSA-N
MW383.50 g/mol
LogP1.56
Rot. Bonds6

About 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide

5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide (PubChem CID 75614179) has the molecular formula C21H29N5O2 and a molecular weight of 383.50 g/mol. Its IUPAC name is 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide
PubChem CID75614179
Molecular FormulaC21H29N5O2
Molecular Weight383.50 g/mol
Exact Mass383.23
IUPAC Name5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide
SMILESO=C(Nc1ccc2c(ccn2CCN2CCOCC2)c1)C1CC(C2CC2)NN1
InChIInChI=1S/C21H29N5O2/c27-21(19-14-18(23-24-19)15-1-2-15)22-17-3-4-20-16(13-17)5-6-26(20)8-7-25-9-11-28-12-10-25/h3-6,13,15,18-19,23-24H,1-2,7-12,14H2,(H,22,27)
InChIKeyJOLLJADBMNQYAN-UHFFFAOYSA-N
XLogP1.56
TPSA70.56 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.50
LogP ≤ 51.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide (CID 75614179) is 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide is O=C(Nc1ccc2c(ccn2CCN2CCOCC2)c1)C1CC(C2CC2)NN1.
What is the InChIKey of 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide?
The InChIKey is JOLLJADBMNQYAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N5O2/c27-21(19-14-18(23-24-19)15-1-2-15)22-17-3-4-20-16(13-17)5-6-26(20)8-7-25-9-11-28-12-10-25/h3-6,13,15,18-19,23-24H,1-2,7-12,14H2,(H,22,27).
What are the key properties of 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide?
5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide has a molecular weight of 383.50 g/mol, XLogP of 1.56, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]pyrazolidine-3-carboxamide is sourced from PubChem (CID 75614179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).