N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide

C16H16N2O2S — CID 95291043

IUPACN,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide
SMILESCc1ccc2oc(C(=O)N(C)[C@@H](C)c3cccs3)cc2n1
InChIInChI=1S/C16H16N2O2S/c1-10-6-7-13-12(17-10)9-14(20-13)16(19)18(3)11(2)15-5-4-8-21-15/h4-9,11H,1-3H3/t11-/m0/s1
InChIKeyDZHAVOFJMAIAHY-NSHDSACASA-N
MW300.38 g/mol
LogP4.03
Rot. Bonds3

About N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide

N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide (PubChem CID 95291043) has the molecular formula C16H16N2O2S and a molecular weight of 300.38 g/mol. Its IUPAC name is N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide
PubChem CID95291043
Molecular FormulaC16H16N2O2S
Molecular Weight300.38 g/mol
Exact Mass300.09
IUPAC NameN,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide
SMILESCc1ccc2oc(C(=O)N(C)[C@@H](C)c3cccs3)cc2n1
InChIInChI=1S/C16H16N2O2S/c1-10-6-7-13-12(17-10)9-14(20-13)16(19)18(3)11(2)15-5-4-8-21-15/h4-9,11H,1-3H3/t11-/m0/s1
InChIKeyDZHAVOFJMAIAHY-NSHDSACASA-N
XLogP4.03
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide?
The IUPAC name of N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide (CID 95291043) is N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide?
The canonical SMILES for N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide is Cc1ccc2oc(C(=O)N(C)[C@@H](C)c3cccs3)cc2n1.
What is the InChIKey of N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide?
The InChIKey is DZHAVOFJMAIAHY-NSHDSACASA-N. The full InChI is InChI=1S/C16H16N2O2S/c1-10-6-7-13-12(17-10)9-14(20-13)16(19)18(3)11(2)15-5-4-8-21-15/h4-9,11H,1-3H3/t11-/m0/s1.
What are the key properties of N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide?
N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide has a molecular weight of 300.38 g/mol, XLogP of 4.03, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]furo[3,2-b]pyridine-2-carboxamide is sourced from PubChem (CID 95291043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).