7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide

C27H26N2O4 — CID 159726035

IUPAC7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide
SMILESCOc1cccc(-c2cc(C(N)=O)c3c(c2)-c2ccc(C(=O)N4CCC[C@@H](O)C4)cc2C3)c1
InChIInChI=1S/C27H26N2O4/c1-33-21-6-2-4-16(11-21)18-12-23-22-8-7-17(27(32)29-9-3-5-20(30)15-29)10-19(22)14-24(23)25(13-18)26(28)31/h2,4,6-8,10-13,20,30H,3,5,9,14-15H2,1H3,(H2,28,31)/t20-/m1/s1
InChIKeyNAQKQKNIDPDHSH-HXUWFJFHSA-N
MW442.52 g/mol
LogP3.63
Rot. Bonds4

About 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide

7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide (PubChem CID 159726035) has the molecular formula C27H26N2O4 and a molecular weight of 442.52 g/mol. Its IUPAC name is 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide.

Molecular Properties

Compound Name7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide
PubChem CID159726035
Molecular FormulaC27H26N2O4
Molecular Weight442.52 g/mol
Exact Mass442.19
IUPAC Name7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide
SMILESCOc1cccc(-c2cc(C(N)=O)c3c(c2)-c2ccc(C(=O)N4CCC[C@@H](O)C4)cc2C3)c1
InChIInChI=1S/C27H26N2O4/c1-33-21-6-2-4-16(11-21)18-12-23-22-8-7-17(27(32)29-9-3-5-20(30)15-29)10-19(22)14-24(23)25(13-18)26(28)31/h2,4,6-8,10-13,20,30H,3,5,9,14-15H2,1H3,(H2,28,31)/t20-/m1/s1
InChIKeyNAQKQKNIDPDHSH-HXUWFJFHSA-N
XLogP3.63
TPSA92.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.52
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide with MolForge

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Related Compounds

7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide
CID 157375270
[(3R)-3-hydroxypiperidin-1-yl]-[2-(3-methoxyphenyl)-1,3-benzoxazol-6-yl]methanone
CID 42526479
3-(3-methoxyphenyl)-7-N-(pyridin-2-ylmethyl)-9H-fluorene-1,7-dicarboxamide
CID 160601958
2-(2-methoxyethoxy)ethyl 2-[8-carbamoyl-6-(3-methoxyphenyl)-9H-fluoren-2-yl]acetate
CID 158776823
(3-hydroxypiperidin-1-yl)-(3-phenylphenyl)methanone
CID 110868609
[(3S)-3-hydroxypiperidin-1-yl]-(3-methoxy-4-methylphenyl)methanone
CID 93033672
3-(4-acetamidophenyl)-7-(4-methylpiperazine-1-carbonyl)-9H-fluorene-1-carboxamide
CID 160879979
4-[(3S)-3-hydroxypiperidine-1-carbonyl]benzamide
CID 93040598
(3-bromopiperidin-1-yl)-(3-methoxyphenyl)methanone
CID 80660380
(3-hydroxyazetidin-1-yl)-(3-methoxyphenyl)methanone
CID 63107497
1-(3-hydroxypiperidin-1-yl)-3-(3-methoxyphenyl)but-2-en-1-one
CID 111911916
3-bromo-7-(4-methylpiperazine-1-carbonyl)-9H-fluorene-1-carboxamide
CID 153105516

Frequently Asked Questions

What is the IUPAC name of 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide?
The IUPAC name of 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide (CID 159726035) is 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide.
What is the SMILES notation for 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide?
The canonical SMILES for 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide is COc1cccc(-c2cc(C(N)=O)c3c(c2)-c2ccc(C(=O)N4CCC[C@@H](O)C4)cc2C3)c1.
What is the InChIKey of 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide?
The InChIKey is NAQKQKNIDPDHSH-HXUWFJFHSA-N. The full InChI is InChI=1S/C27H26N2O4/c1-33-21-6-2-4-16(11-21)18-12-23-22-8-7-17(27(32)29-9-3-5-20(30)15-29)10-19(22)14-24(23)25(13-18)26(28)31/h2,4,6-8,10-13,20,30H,3,5,9,14-15H2,1H3,(H2,28,31)/t20-/m1/s1.
What are the key properties of 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide?
7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide has a molecular weight of 442.52 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3R)-3-hydroxypiperidine-1-carbonyl]-3-(3-methoxyphenyl)-9H-fluorene-1-carboxamide is sourced from PubChem (CID 159726035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).