1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide

C16H18FN3O2 — CID 119135616

IUPAC1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide
SMILESCc1cc(F)cc2[nH]c(C(=O)N3CCC(C(N)=O)CC3)cc12
InChIInChI=1S/C16H18FN3O2/c1-9-6-11(17)7-13-12(9)8-14(19-13)16(22)20-4-2-10(3-5-20)15(18)21/h6-8,10,19H,2-5H2,1H3,(H2,18,21)
InChIKeyOOFWLUFUHVCXFI-UHFFFAOYSA-N
MW303.34 g/mol
LogP1.95
Rot. Bonds2

About 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide

1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide (PubChem CID 119135616) has the molecular formula C16H18FN3O2 and a molecular weight of 303.34 g/mol. Its IUPAC name is 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide
PubChem CID119135616
Molecular FormulaC16H18FN3O2
Molecular Weight303.34 g/mol
Exact Mass303.14
IUPAC Name1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide
SMILESCc1cc(F)cc2[nH]c(C(=O)N3CCC(C(N)=O)CC3)cc12
InChIInChI=1S/C16H18FN3O2/c1-9-6-11(17)7-13-12(9)8-14(19-13)16(22)20-4-2-10(3-5-20)15(18)21/h6-8,10,19H,2-5H2,1H3,(H2,18,21)
InChIKeyOOFWLUFUHVCXFI-UHFFFAOYSA-N
XLogP1.95
TPSA79.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.34
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[(3R,4R)-3,4-diaminopyrrolidin-1-yl]-(6-fluoro-4-methyl-1H-indol-2-yl)methanone
CID 155954106
1-(5-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide
CID 7326182
1-(3-fluoro-5-methylbenzoyl)piperidine-4-carboxamide
CID 119138735
2-[(2R)-4-(6-fluoro-4-methyl-1H-indole-2-carbonyl)morpholin-2-yl]acetic acid
CID 124695833
(2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl)-(6-fluoro-4-methyl-1H-indol-2-yl)methanone
CID 142576436
(4,6-dimethyl-1H-indol-2-yl)-(4-phenylpiperidin-1-yl)methanone
CID 39581120
azetidin-1-yl-(4-chloro-6-fluoro-1H-indol-2-yl)methanone
CID 166285155
(4-chloro-6-fluoro-1H-indol-2-yl)-(4-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 166286465
(6-fluoro-4-methyl-1H-indol-2-yl)-[(2S,4R)-2-(hydroxymethyl)-4-methoxypyrrolidin-1-yl]methanone
CID 128984786
1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide
CID 69283945
1-(3,4-dimethylbenzoyl)piperidine-4-carboxamide
CID 2935139
(4,6-dimethyl-1H-indol-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone
CID 78828303

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide (CID 119135616) is 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide is Cc1cc(F)cc2[nH]c(C(=O)N3CCC(C(N)=O)CC3)cc12.
What is the InChIKey of 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is OOFWLUFUHVCXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O2/c1-9-6-11(17)7-13-12(9)8-14(19-13)16(22)20-4-2-10(3-5-20)15(18)21/h6-8,10,19H,2-5H2,1H3,(H2,18,21).
What are the key properties of 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide?
1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 303.34 g/mol, XLogP of 1.95, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 119135616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).