2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide

C19H25N3O3 — CID 71990287

IUPAC2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide
SMILESCc1cc(C(=O)NCC(=O)NC(c2ncccc2C)C(C)C)c(C)o1
InChIInChI=1S/C19H25N3O3/c1-11(2)17(18-12(3)7-6-8-20-18)22-16(23)10-21-19(24)15-9-13(4)25-14(15)5/h6-9,11,17H,10H2,1-5H3,(H,21,24)(H,22,23)
InChIKeyULEYRGKFMZSCPE-UHFFFAOYSA-N
MW343.43 g/mol
LogP2.84
Rot. Bonds6

About 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide

2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide (PubChem CID 71990287) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide
PubChem CID71990287
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide
SMILESCc1cc(C(=O)NCC(=O)NC(c2ncccc2C)C(C)C)c(C)o1
InChIInChI=1S/C19H25N3O3/c1-11(2)17(18-12(3)7-6-8-20-18)22-16(23)10-21-19(24)15-9-13(4)25-14(15)5/h6-9,11,17H,10H2,1-5H3,(H,21,24)(H,22,23)
InChIKeyULEYRGKFMZSCPE-UHFFFAOYSA-N
XLogP2.84
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide (CID 71990287) is 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide is Cc1cc(C(=O)NCC(=O)NC(c2ncccc2C)C(C)C)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
The InChIKey is ULEYRGKFMZSCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-11(2)17(18-12(3)7-6-8-20-18)22-16(23)10-21-19(24)15-9-13(4)25-14(15)5/h6-9,11,17H,10H2,1-5H3,(H,21,24)(H,22,23).
What are the key properties of 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide?
2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[2-[[2-methyl-1-(3-methyl-2-pyridinyl)propyl]amino]-2-oxoethyl]furan-3-carboxamide is sourced from PubChem (CID 71990287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).