7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide

C28H29N5O3 — CID 147925971

IUPAC7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide
SMILESNC(=O)c1cc(-c2cnc(N3CCCCC3)nc2)cc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2
InChIInChI=1S/C28H29N5O3/c29-26(34)25-14-19(21-16-30-28(31-17-21)33-6-2-1-3-7-33)13-23-22-5-4-18(12-20(22)15-24(23)25)27(35)32-8-10-36-11-9-32/h4-5,12-14,16-17H,1-3,6-11,15H2,(H2,29,34)
InChIKeyIIXSKHDEYLDSBG-UHFFFAOYSA-N
MW483.57 g/mol
LogP3.28
Rot. Bonds4

About 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide

7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide (PubChem CID 147925971) has the molecular formula C28H29N5O3 and a molecular weight of 483.57 g/mol. Its IUPAC name is 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide.

Molecular Properties

Compound Name7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide
PubChem CID147925971
Molecular FormulaC28H29N5O3
Molecular Weight483.57 g/mol
Exact Mass483.23
IUPAC Name7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide
SMILESNC(=O)c1cc(-c2cnc(N3CCCCC3)nc2)cc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2
InChIInChI=1S/C28H29N5O3/c29-26(34)25-14-19(21-16-30-28(31-17-21)33-6-2-1-3-7-33)13-23-22-5-4-18(12-20(22)15-24(23)25)27(35)32-8-10-36-11-9-32/h4-5,12-14,16-17H,1-3,6-11,15H2,(H2,29,34)
InChIKeyIIXSKHDEYLDSBG-UHFFFAOYSA-N
XLogP3.28
TPSA101.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.57
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(2-cyanopyrimidin-5-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 159940152
7-(morpholine-4-carbonyl)-3-(4-morpholin-4-ylphenyl)-9H-fluorene-1-carboxamide
CID 149273217
7-(morpholine-4-carbonyl)-3-(2-phenylmethoxypyrimidin-5-yl)-9H-fluorene-1-carboxamide
CID 148746011
7-(morpholine-4-carbonyl)-3-thiophen-3-yl-9H-fluorene-1-carboxamide
CID 159441478
3-(3-chloro-4-pyridinyl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 161097757
3-(cyclohexen-1-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 146686457
3-(2-methyl-1,3-thiazol-4-yl)-7-(morpholine-4-carbonyl)-9H-fluorene-1-carboxamide
CID 152964048
morpholin-4-yl-(2-pyrrolidin-1-ylpyrimidin-5-yl)methanone
CID 20863908
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
7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide
CID 157375270
3-bromo-7-(4-methylpiperazine-1-carbonyl)-9H-fluorene-1-carboxamide
CID 153105516

Frequently Asked Questions

What is the IUPAC name of 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide?
The IUPAC name of 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide (CID 147925971) is 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide.
What is the SMILES notation for 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide?
The canonical SMILES for 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide is NC(=O)c1cc(-c2cnc(N3CCCCC3)nc2)cc2c1Cc1cc(C(=O)N3CCOCC3)ccc1-2.
What is the InChIKey of 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide?
The InChIKey is IIXSKHDEYLDSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29N5O3/c29-26(34)25-14-19(21-16-30-28(31-17-21)33-6-2-1-3-7-33)13-23-22-5-4-18(12-20(22)15-24(23)25)27(35)32-8-10-36-11-9-32/h4-5,12-14,16-17H,1-3,6-11,15H2,(H2,29,34).
What are the key properties of 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide?
7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide has a molecular weight of 483.57 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(morpholine-4-carbonyl)-3-(2-piperidin-1-ylpyrimidin-5-yl)-9H-fluorene-1-carboxamide is sourced from PubChem (CID 147925971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).