3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide

C25H26N2O3 — CID 146686457

IUPAC3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
SMILESNC(=O)c1cc(C2=CCCCC2)cc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2
InChIInChI=1S/C25H26N2O3/c26-24(28)23-14-18(16-4-2-1-3-5-16)13-21-20-7-6-17(12-19(20)15-22(21)23)25(29)27-8-10-30-11-9-27/h4,6-7,12-14H,1-3,5,8-11,15H2,(H2,26,28)
InChIKeyPPTQBAHLUJPZMI-UHFFFAOYSA-N
MW402.49 g/mol
LogP3.79
Rot. Bonds3

About 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide

3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide (PubChem CID 146686457) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide.

Molecular Properties

Compound Name3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
PubChem CID146686457
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC Name3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
SMILESNC(=O)c1cc(C2=CCCCC2)cc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2
InChIInChI=1S/C25H26N2O3/c26-24(28)23-14-18(16-4-2-1-3-5-16)13-21-20-7-6-17(12-19(20)15-22(21)23)25(29)27-8-10-30-11-9-27/h4,6-7,12-14H,1-3,5,8-11,15H2,(H2,26,28)
InChIKeyPPTQBAHLUJPZMI-UHFFFAOYSA-N
XLogP3.79
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-(morpholine-4-carbonyl)-3-(4-morpholin-4-ylphenyl)-9H-fluorene-1-carboxamide
CID 149273217
7-(morpholine-4-carbonyl)-3-thiophen-3-yl-9H-fluorene-1-carboxamide
CID 159441478
7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide
CID 147925971
3-(3-chloro-4-pyridinyl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 161097757
3-(2-cyanopyrimidin-5-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 159940152
3-(2-methyl-1,3-thiazol-4-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 152964048
7-(morpholine-4-carbonyl)-3-(2-phenylmethoxypyrimidin-5-yl)-9H-fluorene-1-carboxamide
CID 148746011
7-morpholin-4-yl-3-phenyl-9H-fluorene-1-carboxamide
CID 158093080
3-(4-acetamidophenyl)-7-(4-methylpiperazine-1-carbonyl)-9H-fluorene-1-carboxamide
CID 160879979
3-bromo-7-(4-methylpiperazine-1-carbonyl)-9H-fluorene-1-carboxamide
CID 153105516
7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide
CID 157375270
7-(1,1-dioxo-1,4-thiazinane-4-carbonyl)-3-(3-fluoro-4-methoxyphenyl)-9H-fluorene-1-carboxamide
CID 146851107

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide?
The IUPAC name of 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide (CID 146686457) is 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide.
What is the SMILES notation for 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide?
The canonical SMILES for 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide is NC(=O)c1cc(C2=CCCCC2)cc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2.
What is the InChIKey of 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide?
The InChIKey is PPTQBAHLUJPZMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c26-24(28)23-14-18(16-4-2-1-3-5-16)13-21-20-7-6-17(12-19(20)15-22(21)23)25(29)27-8-10-30-11-9-27/h4,6-7,12-14H,1-3,5,8-11,15H2,(H2,26,28).
What are the key properties of 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide?
3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide has a molecular weight of 402.49 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide is sourced from PubChem (CID 146686457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).