N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide

C23H29N3O2 — CID 18161354

IUPACN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide
SMILESO=C(CCCc1c[nH]c2ccccc12)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C23H29N3O2/c27-23(12-6-8-18-16-24-20-10-3-2-9-19(18)20)25-17-21(22-11-7-15-28-22)26-13-4-1-5-14-26/h2-3,7,9-11,15-16,21,24H,1,4-6,8,12-14,17H2,(H,25,27)
InChIKeyHPMKCWFDGBPKQX-UHFFFAOYSA-N
MW379.50 g/mol
LogP4.43
Rot. Bonds8

About N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide

N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide (PubChem CID 18161354) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide
PubChem CID18161354
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide
SMILESO=C(CCCc1c[nH]c2ccccc12)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C23H29N3O2/c27-23(12-6-8-18-16-24-20-10-3-2-9-19(18)20)25-17-21(22-11-7-15-28-22)26-13-4-1-5-14-26/h2-3,7,9-11,15-16,21,24H,1,4-6,8,12-14,17H2,(H,25,27)
InChIKeyHPMKCWFDGBPKQX-UHFFFAOYSA-N
XLogP4.43
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(1H-indol-3-yl)propanamide
CID 4807743
3-(1H-indol-3-yl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)propanamide
CID 51186547
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-(1H-indol-3-yl)butanamide
CID 2481341
N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]butanamide
CID 112503325
4-chloro-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 55204450
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 60636600
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 93157841
N-[2-(furan-2-yl)-2-hydroxyethyl]-3-(1H-indol-3-yl)propanamide
CID 110889323
N'-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(furan-2-yl)ethyl]-N-[2-(1H-indol-3-yl)ethyl]oxamide
CID 12006004
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-phenylpropanamide
CID 7780304
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-phenoxybutanamide
CID 51162656
3-(1H-indol-3-yl)-N-[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]propanamide
CID 2552209

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide?
The IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide (CID 18161354) is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide is O=C(CCCc1c[nH]c2ccccc12)NCC(c1ccco1)N1CCCCC1.
What is the InChIKey of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide?
The InChIKey is HPMKCWFDGBPKQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2/c27-23(12-6-8-18-16-24-20-10-3-2-9-19(18)20)25-17-21(22-11-7-15-28-22)26-13-4-1-5-14-26/h2-3,7,9-11,15-16,21,24H,1,4-6,8,12-14,17H2,(H,25,27).
What are the key properties of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide?
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide has a molecular weight of 379.50 g/mol, XLogP of 4.43, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-(1H-indol-3-yl)butanamide is sourced from PubChem (CID 18161354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).