N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide

C17H20N2O2 — CID 121196766

IUPACN-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide
SMILESO=C(NCc1ccc(-c2ccoc2)nc1)C1CCCCC1
InChIInChI=1S/C17H20N2O2/c20-17(14-4-2-1-3-5-14)19-11-13-6-7-16(18-10-13)15-8-9-21-12-15/h6-10,12,14H,1-5,11H2,(H,19,20)
InChIKeyZNZCWITXZUTHKX-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.54
Rot. Bonds4

About N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide

N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide (PubChem CID 121196766) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide
PubChem CID121196766
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide
SMILESO=C(NCc1ccc(-c2ccoc2)nc1)C1CCCCC1
InChIInChI=1S/C17H20N2O2/c20-17(14-4-2-1-3-5-14)19-11-13-6-7-16(18-10-13)15-8-9-21-12-15/h6-10,12,14H,1-5,11H2,(H,19,20)
InChIKeyZNZCWITXZUTHKX-UHFFFAOYSA-N
XLogP3.54
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[6-(furan-3-yl)-3-pyridinyl]methyl]-3,4-dihydro-2H-chromene-2-carboxamide
CID 119105261
N-[[6-(furan-3-yl)-3-pyridinyl]methyl]-4-propylbenzamide
CID 121022431
N-[[6-(furan-3-yl)-3-pyridinyl]methyl]-4-methoxybenzamide
CID 121196612
2-fluoro-N-[[6-(furan-3-yl)-3-pyridinyl]methyl]benzamide
CID 121196604
N-[[6-(furan-3-yl)-3-pyridinyl]methyl]-3-phenylbutanamide
CID 121196825
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[6-(furan-3-yl)-3-pyridinyl]methyl]urea
CID 121022475
N-[[5-(furan-3-yl)-3-pyridinyl]methyl]cyclohex-3-ene-1-carboxamide
CID 119106241
2-(3,4-dimethoxyphenyl)-N-[[6-(furan-3-yl)-3-pyridinyl]methyl]acetamide
CID 121196651
N-[[6-(furan-3-yl)-3-pyridinyl]methyl]-2,1,3-benzothiadiazole-5-carboxamide
CID 119105213
N-[(6-pyrazol-1-yl-3-pyridinyl)methyl]cyclopentanecarboxamide
CID 25343497
2-(1,2-benzoxazol-3-yl)-N-[[6-(furan-3-yl)-3-pyridinyl]methyl]acetamide
CID 119105233
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[[6-(furan-3-yl)-3-pyridinyl]methyl]acetamide
CID 121022451

Frequently Asked Questions

What is the IUPAC name of N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide?
The IUPAC name of N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide (CID 121196766) is N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide?
The canonical SMILES for N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide is O=C(NCc1ccc(-c2ccoc2)nc1)C1CCCCC1.
What is the InChIKey of N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide?
The InChIKey is ZNZCWITXZUTHKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-17(14-4-2-1-3-5-14)19-11-13-6-7-16(18-10-13)15-8-9-21-12-15/h6-10,12,14H,1-5,11H2,(H,19,20).
What are the key properties of N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide?
N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide has a molecular weight of 284.36 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(furan-3-yl)-3-pyridinyl]methyl]cyclohexanecarboxamide is sourced from PubChem (CID 121196766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).