3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide

C18H16FN3O — CID 130362491

IUPAC3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(F)c(C2=CCCNC2)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/h1-2,4-6,8,21-22H,3,7,9H2,(H2,20,23)
InChIKeyDSHSGSPICYXZAL-UHFFFAOYSA-N
MW309.34 g/mol
LogP2.94
Rot. Bonds2

About 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide

3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide (PubChem CID 130362491) has the molecular formula C18H16FN3O and a molecular weight of 309.34 g/mol. Its IUPAC name is 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide.

Molecular Properties

Compound Name3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
PubChem CID130362491
Molecular FormulaC18H16FN3O
Molecular Weight309.34 g/mol
Exact Mass309.13
IUPAC Name3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
SMILESNC(=O)c1cc(F)c(C2=CCCNC2)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/h1-2,4-6,8,21-22H,3,7,9H2,(H2,20,23)
InChIKeyDSHSGSPICYXZAL-UHFFFAOYSA-N
XLogP2.94
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 ≤ 52.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-2,3-dimethyl-4-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole-7-carboxamide
CID 121293797
3-fluoro-4-(1,2,3,4-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide
CID 130362309
5-fluoro-2,3-dimethyl-4-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole-7-carboxamide;2,2,2-trifluoroacetic acid
CID 131747448
4-(2,3-dihydro-1H-indol-4-yl)-3-fluoro-9H-carbazole-1-carboxamide
CID 130362497
3-fluoro-4-(1-prop-1-enyl-3,6-dihydro-2H-pyridin-5-yl)-7-(trifluoromethyl)-9H-carbazole-1-carboxamide
CID 150466686
4-[(6-chloro-3-pyridinyl)methyl]-3-fluoro-9H-carbazole-1-carboxamide
CID 130362469
2-methyl-4-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole-7-carboxamide
CID 175395348
9H-carbazole-1-carboxamide;hydrochloride
CID 141272518
4-amino-3-fluoro-7-(4-methylpiperazine-1-carbonyl)-9H-carbazole-1-carboxamide
CID 145069415
4-[(5S)-5-aminocyclohexen-1-yl]-5-fluoro-2,3-dimethyl-1H-indole-7-carboxamide
CID 164585782
4-[(5S)-5-aminocyclohexen-1-yl]-5-fluoro-2,3-dimethyl-1H-indole-7-carboxamide;hydrochloride
CID 164585861
1-phenyl-9H-carbazole-2-carboxamide
CID 174872973

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
The IUPAC name of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide (CID 130362491) is 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide.
What is the SMILES notation for 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
The canonical SMILES for 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide is NC(=O)c1cc(F)c(C2=CCCNC2)c2c1[nH]c1ccccc12.
What is the InChIKey of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
The InChIKey is DSHSGSPICYXZAL-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/h1-2,4-6,8,21-22H,3,7,9H2,(H2,20,23).
What are the key properties of 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide?
3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide has a molecular weight of 309.34 g/mol, XLogP of 2.94, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(1,2,3,6-tetrahydropyridin-5-yl)-9H-carbazole-1-carboxamide is sourced from PubChem (CID 130362491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).