N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide

C19H24N2O2 — CID 4883742

IUPACN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C19H24N2O2/c1-15-8-3-4-9-16(15)19(22)20-14-17(18-10-7-13-23-18)21-11-5-2-6-12-21/h3-4,7-10,13,17H,2,5-6,11-12,14H2,1H3,(H,20,22)
InChIKeyQBHRBVVAYOFIHG-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.55
Rot. Bonds5

About N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide

N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide (PubChem CID 4883742) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide
PubChem CID4883742
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide
SMILESCc1ccccc1C(=O)NCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C19H24N2O2/c1-15-8-3-4-9-16(15)19(22)20-14-17(18-10-7-13-23-18)21-11-5-2-6-12-21/h3-4,7-10,13,17H,2,5-6,11-12,14H2,1H3,(H,20,22)
InChIKeyQBHRBVVAYOFIHG-UHFFFAOYSA-N
XLogP3.55
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-methylbenzamide
CID 43842816
N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylsulfanylbenzamide
CID 2456837
2-fluoro-N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide
CID 26834331
N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]naphthalene-1-carboxamide
CID 26834307
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-(trifluoromethyl)benzamide
CID 4807708
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-piperidin-1-ylsulfonylbenzamide
CID 55330211
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]benzamide;hydrochloride
CID 52985069
N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-(2-methylphenoxy)acetamide
CID 26834283
N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-methylbenzamide
CID 26834257
2-chloro-N-[2-[[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-2-oxoethyl]benzamide
CID 7972625
2-ethoxy-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]pyridine-3-carboxamide
CID 4878101
2,4-dichloro-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]benzamide
CID 18161350

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide?
The IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide (CID 4883742) is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide is Cc1ccccc1C(=O)NCC(c1ccco1)N1CCCCC1.
What is the InChIKey of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide?
The InChIKey is QBHRBVVAYOFIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15-8-3-4-9-16(15)19(22)20-14-17(18-10-7-13-23-18)21-11-5-2-6-12-21/h3-4,7-10,13,17H,2,5-6,11-12,14H2,1H3,(H,20,22).
What are the key properties of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide?
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylbenzamide has a molecular weight of 312.41 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 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]-2-methylbenzamide is sourced from PubChem (CID 4883742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).