N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide

C16H20N2O2 — CID 56760381

IUPACN,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide
SMILESCc1cccnc1CC(C)N(C)C(=O)c1ccoc1C
InChIInChI=1S/C16H20N2O2/c1-11-6-5-8-17-15(11)10-12(2)18(4)16(19)14-7-9-20-13(14)3/h5-9,12H,10H2,1-4H3
InChIKeyIWNTZSFTUDFGLY-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.99
Rot. Bonds4

About N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide

N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide (PubChem CID 56760381) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide
PubChem CID56760381
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide
SMILESCc1cccnc1CC(C)N(C)C(=O)c1ccoc1C
InChIInChI=1S/C16H20N2O2/c1-11-6-5-8-17-15(11)10-12(2)18(4)16(19)14-7-9-20-13(14)3/h5-9,12H,10H2,1-4H3
InChIKeyIWNTZSFTUDFGLY-UHFFFAOYSA-N
XLogP2.99
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide?
The IUPAC name of N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide (CID 56760381) is N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide.
What is the SMILES notation for N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide?
The canonical SMILES for N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide is Cc1cccnc1CC(C)N(C)C(=O)c1ccoc1C.
What is the InChIKey of N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide?
The InChIKey is IWNTZSFTUDFGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-11-6-5-8-17-15(11)10-12(2)18(4)16(19)14-7-9-20-13(14)3/h5-9,12H,10H2,1-4H3.
What are the key properties of N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide?
N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.99, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[1-(3-methyl-2-pyridinyl)propan-2-yl]furan-3-carboxamide is sourced from PubChem (CID 56760381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).