2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide

C16H26N2O2 — CID 83198706

IUPAC2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide
SMILESCc1ccc(C(C)NC(=O)C(C)(C)C2CCCNC2)o1
InChIInChI=1S/C16H26N2O2/c1-11-7-8-14(20-11)12(2)18-15(19)16(3,4)13-6-5-9-17-10-13/h7-8,12-13,17H,5-6,9-10H2,1-4H3,(H,18,19)
InChIKeyNKNVUZYCDQYUGU-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.79
Rot. Bonds4

About 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide

2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide (PubChem CID 83198706) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide.

Molecular Properties

Compound Name2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide
PubChem CID83198706
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide
SMILESCc1ccc(C(C)NC(=O)C(C)(C)C2CCCNC2)o1
InChIInChI=1S/C16H26N2O2/c1-11-7-8-14(20-11)12(2)18-15(19)16(3,4)13-6-5-9-17-10-13/h7-8,12-13,17H,5-6,9-10H2,1-4H3,(H,18,19)
InChIKeyNKNVUZYCDQYUGU-UHFFFAOYSA-N
XLogP2.79
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[(1R)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylpropanamide
CID 83200384
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83200383
N-[(1S)-1-(4-bromophenyl)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83200389
N-[1-(5-methylfuran-2-yl)ethyl]piperidine-3-carboxamide
CID 43703387
N-[1-(3-fluorophenyl)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83034283
N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83198749
2-hydroxy-2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]propanamide
CID 104936607
N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83031807
N-(2-fluorophenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83031990
N,2-dimethyl-2-piperidin-3-ylpropanamide
CID 83031239
2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid
CID 83198884
N-(3,5-dimethylphenyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 83031146

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide?
The IUPAC name of 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide (CID 83198706) is 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide.
What is the SMILES notation for 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide?
The canonical SMILES for 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide is Cc1ccc(C(C)NC(=O)C(C)(C)C2CCCNC2)o1.
What is the InChIKey of 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide?
The InChIKey is NKNVUZYCDQYUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-11-7-8-14(20-11)12(2)18-15(19)16(3,4)13-6-5-9-17-10-13/h7-8,12-13,17H,5-6,9-10H2,1-4H3,(H,18,19).
What are the key properties of 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide?
2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide has a molecular weight of 278.40 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-2-piperidin-3-ylpropanamide is sourced from PubChem (CID 83198706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).