(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide

C21H20FN3O2 — CID 41091330

IUPAC(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)[C@@H]1CCCN(C(=O)c2ccc3cc[nH]c3c2)C1
InChIInChI=1S/C21H20FN3O2/c22-17-4-1-5-18(12-17)24-20(26)16-3-2-10-25(13-16)21(27)15-7-6-14-8-9-23-19(14)11-15/h1,4-9,11-12,16,23H,2-3,10,13H2,(H,24,26)/t16-/m1/s1
InChIKeyXMRLAWHXSUGJJR-MRXNPFEDSA-N
MW365.41 g/mol
LogP3.80
Rot. Bonds3

About (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide

(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide (PubChem CID 41091330) has the molecular formula C21H20FN3O2 and a molecular weight of 365.41 g/mol. Its IUPAC name is (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide
PubChem CID41091330
Molecular FormulaC21H20FN3O2
Molecular Weight365.41 g/mol
Exact Mass365.15
IUPAC Name(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)[C@@H]1CCCN(C(=O)c2ccc3cc[nH]c3c2)C1
InChIInChI=1S/C21H20FN3O2/c22-17-4-1-5-18(12-17)24-20(26)16-3-2-10-25(13-16)21(27)15-7-6-14-8-9-23-19(14)11-15/h1,4-9,11-12,16,23H,2-3,10,13H2,(H,24,26)/t16-/m1/s1
InChIKeyXMRLAWHXSUGJJR-MRXNPFEDSA-N
XLogP3.80
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetylphenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide
CID 42650295
(3R)-N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-3-carboxamide
CID 94082579
(3R)-N-(4-acetamidophenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
CID 41087933
(3S)-1-acetyl-N-(3-fluorophenyl)piperidine-3-carboxamide
CID 9068167
N-(3-cyanophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 51271965
(3S)-N-(3,5-dimethoxyphenyl)-1-(1H-indole-5-carbonyl)piperidine-3-carboxamide
CID 41129492
N-[4-(3-fluorophenyl)phenyl]-1-(pyridine-4-carbonyl)piperidine-3-carboxamide
CID 45208634
[1-(1H-indole-6-carbonyl)piperidin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 51128572
(3R)-1-[3-(trifluoromethyl)benzoyl]-N-[3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 94082199
(3S)-N-[3-(4-fluorophenyl)phenyl]-1-(6-methylpyridine-3-carbonyl)piperidine-3-carboxamide
CID 42401368
1-[3-[(4-fluorobenzoyl)amino]benzoyl]piperidine-3-carboxylic acid
CID 119167379
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 46449131

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide (CID 41091330) is (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide is O=C(Nc1cccc(F)c1)[C@@H]1CCCN(C(=O)c2ccc3cc[nH]c3c2)C1.
What is the InChIKey of (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide?
The InChIKey is XMRLAWHXSUGJJR-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H20FN3O2/c22-17-4-1-5-18(12-17)24-20(26)16-3-2-10-25(13-16)21(27)15-7-6-14-8-9-23-19(14)11-15/h1,4-9,11-12,16,23H,2-3,10,13H2,(H,24,26)/t16-/m1/s1.
What are the key properties of (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide?
(3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide has a molecular weight of 365.41 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(3-fluorophenyl)-1-(1H-indole-6-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 41091330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).