5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide

C19H21N3O2 — CID 154735869

IUPAC5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide
SMILESCc1ccc(N(C(=O)c2cc(C#N)oc2C)C2CCCCC2)nc1
InChIInChI=1S/C19H21N3O2/c1-13-8-9-18(21-12-13)22(15-6-4-3-5-7-15)19(23)17-10-16(11-20)24-14(17)2/h8-10,12,15H,3-7H2,1-2H3
InChIKeyVNZJAJKWFLSMRR-UHFFFAOYSA-N
MW323.40 g/mol
LogP4.14
Rot. Bonds3

About 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide

5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide (PubChem CID 154735869) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide.

Molecular Properties

Compound Name5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide
PubChem CID154735869
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide
SMILESCc1ccc(N(C(=O)c2cc(C#N)oc2C)C2CCCCC2)nc1
InChIInChI=1S/C19H21N3O2/c1-13-8-9-18(21-12-13)22(15-6-4-3-5-7-15)19(23)17-10-16(11-20)24-14(17)2/h8-10,12,15H,3-7H2,1-2H3
InChIKeyVNZJAJKWFLSMRR-UHFFFAOYSA-N
XLogP4.14
TPSA70.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide?
The IUPAC name of 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide (CID 154735869) is 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide.
What is the SMILES notation for 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide?
The canonical SMILES for 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide is Cc1ccc(N(C(=O)c2cc(C#N)oc2C)C2CCCCC2)nc1.
What is the InChIKey of 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide?
The InChIKey is VNZJAJKWFLSMRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-13-8-9-18(21-12-13)22(15-6-4-3-5-7-15)19(23)17-10-16(11-20)24-14(17)2/h8-10,12,15H,3-7H2,1-2H3.
What are the key properties of 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide?
5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 4.14, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide is sourced from PubChem (CID 154735869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).