N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide

C19H25N3O2 — CID 110643519

IUPACN,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(C(=O)c2c[nH]c3ccccc23)CC1
InChIInChI=1S/C19H25N3O2/c1-3-21(4-2)19(24)22-11-9-14(10-12-22)18(23)16-13-20-17-8-6-5-7-15(16)17/h5-8,13-14,20H,3-4,9-12H2,1-2H3
InChIKeyFKYRBSUKZBMXDC-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.52
Rot. Bonds4

About N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide

N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide (PubChem CID 110643519) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide
PubChem CID110643519
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(C(=O)c2c[nH]c3ccccc23)CC1
InChIInChI=1S/C19H25N3O2/c1-3-21(4-2)19(24)22-11-9-14(10-12-22)18(23)16-13-20-17-8-6-5-7-15(16)17/h5-8,13-14,20H,3-4,9-12H2,1-2H3
InChIKeyFKYRBSUKZBMXDC-UHFFFAOYSA-N
XLogP3.52
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide?
The IUPAC name of N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide (CID 110643519) is N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide.
What is the SMILES notation for N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide?
The canonical SMILES for N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide is CCN(CC)C(=O)N1CCC(C(=O)c2c[nH]c3ccccc23)CC1.
What is the InChIKey of N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide?
The InChIKey is FKYRBSUKZBMXDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-3-21(4-2)19(24)22-11-9-14(10-12-22)18(23)16-13-20-17-8-6-5-7-15(16)17/h5-8,13-14,20H,3-4,9-12H2,1-2H3.
What are the key properties of N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide?
N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide is sourced from PubChem (CID 110643519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).