3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide

C18H16FN3O — CID 130362309

IUPAC3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(F)c(C2=CNCCC2)c2c1[nH]c1ccccc12
InChIInChI=1S/C18H16FN3O/c19-13-8-12(18(20)23)17-16(11-5-1-2-6-14(11)22-17)15(13)10-4-3-7-21-9-10/h1-2,5-6,8-9,21-22H,3-4,7H2,(H2,20,23)
InChIKeyXGPZNGQLLBYCCM-UHFFFAOYSA-N
MW309.34 g/mol
LogP3.28
Rot. Bonds2

About 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide

3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide (PubChem CID 130362309) has the molecular formula C18H16FN3O and a molecular weight of 309.34 g/mol. Its IUPAC name is 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide.

Molecular Properties

Compound Name3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
PubChem CID130362309
Molecular FormulaC18H16FN3O
Molecular Weight309.34 g/mol
Exact Mass309.13
IUPAC Name3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(F)c(C2=CNCCC2)c2c1[nH]c1ccccc12
InChIInChI=1S/C18H16FN3O/c19-13-8-12(18(20)23)17-16(11-5-1-2-6-14(11)22-17)15(13)10-4-3-7-21-9-10/h1-2,5-6,8-9,21-22H,3-4,7H2,(H2,20,23)
InChIKeyXGPZNGQLLBYCCM-UHFFFAOYSA-N
XLogP3.28
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.34
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
CID 130362491
4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide
CID 130362497
4-[(6-chloro-3-pyridinyl)methyl]-3-fluoro-9H-carbazole-1-carboxamide
CID 130362469
3-fluoro-4-(1-prop-1-enyl-3,6-dihydro-2H-pyridin-5-yl)-7-(trifluoromethyl)-9H-carbazole-1-carboxamide
CID 150466686
4-amino-3-fluoro-7-(4-methylpiperazine-1-carbonyl)-9H-carbazole-1-carboxamide
CID 145069415
9H-carbazole-1-carboxamide;hydrochloride
CID 141272518
5-fluoro-2,3-dimethyl-4-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole-7-carboxamide
CID 121293797
1-(benzenesulfonyl)-9H-carbazole-4-carboxamide
CID 144692825
tert-butyl 5-(1-carbamoyl-3-fluoro-9H-carbazol-4-yl)-3,3a,4,6,7,7a-hexahydro-2H-pyrrolo[3,2-c]pyridine-1-carboxylate
CID 130362479
8-[(5S)-5-aminocyclohexen-1-yl]-7-fluoro-1,2,3,4-tetrahydrocyclopenta[b]indole-5-carboxamide
CID 156888365
but-2-ynamide;3-chloro-4-(cyclohexen-1-yl)-5-fluoro-2-methyl-1H-indole-7-carboxamide
CID 164585673
1-phenyl-9H-carbazole-2-carboxamide
CID 174872973

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
The IUPAC name of 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide (CID 130362309) is 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide.
What is the SMILES notation for 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
The canonical SMILES for 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide is NC(=O)c1cc(F)c(C2=CNCCC2)c2c1[nH]c1ccccc12.
What is the InChIKey of 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
The InChIKey is XGPZNGQLLBYCCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O/c19-13-8-12(18(20)23)17-16(11-5-1-2-6-14(11)22-17)15(13)10-4-3-7-21-9-10/h1-2,5-6,8-9,21-22H,3-4,7H2,(H2,20,23).
What are the key properties of 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide has a molecular weight of 309.34 g/mol, XLogP of 3.28, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide is sourced from PubChem (CID 130362309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).