5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide

C20H26FN3O2 — CID 77095932

IUPAC5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide
SMILESCn1c(C(=O)NC2(CN3CCOCC3)CCCC2)cc2cc(F)ccc21
InChIInChI=1S/C20H26FN3O2/c1-23-17-5-4-16(21)12-15(17)13-18(23)19(25)22-20(6-2-3-7-20)14-24-8-10-26-11-9-24/h4-5,12-13H,2-3,6-11,14H2,1H3,(H,22,25)
InChIKeyAYKLBLXIYXOSTC-UHFFFAOYSA-N
MW359.45 g/mol
LogP2.69
Rot. Bonds4

About 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide

5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide (PubChem CID 77095932) has the molecular formula C20H26FN3O2 and a molecular weight of 359.45 g/mol. Its IUPAC name is 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide
PubChem CID77095932
Molecular FormulaC20H26FN3O2
Molecular Weight359.45 g/mol
Exact Mass359.20
IUPAC Name5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide
SMILESCn1c(C(=O)NC2(CN3CCOCC3)CCCC2)cc2cc(F)ccc21
InChIInChI=1S/C20H26FN3O2/c1-23-17-5-4-16(21)12-15(17)13-18(23)19(25)22-20(6-2-3-7-20)14-24-8-10-26-11-9-24/h4-5,12-13H,2-3,6-11,14H2,1H3,(H,22,25)
InChIKeyAYKLBLXIYXOSTC-UHFFFAOYSA-N
XLogP2.69
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.45
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide?
The IUPAC name of 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide (CID 77095932) is 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide.
What is the SMILES notation for 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide?
The canonical SMILES for 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide is Cn1c(C(=O)NC2(CN3CCOCC3)CCCC2)cc2cc(F)ccc21.
What is the InChIKey of 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide?
The InChIKey is AYKLBLXIYXOSTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26FN3O2/c1-23-17-5-4-16(21)12-15(17)13-18(23)19(25)22-20(6-2-3-7-20)14-24-8-10-26-11-9-24/h4-5,12-13H,2-3,6-11,14H2,1H3,(H,22,25).
What are the key properties of 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide?
5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide has a molecular weight of 359.45 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-methyl-N-[1-(morpholin-4-ylmethyl)cyclopentyl]indole-2-carboxamide is sourced from PubChem (CID 77095932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).