N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

C15H20N4O2 — CID 97461841

IUPACN,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCc1ccc(CN2CCc3[nH]nc(C(=O)N(C)C)c3C2)o1
InChIInChI=1S/C15H20N4O2/c1-10-4-5-11(21-10)8-19-7-6-13-12(9-19)14(17-16-13)15(20)18(2)3/h4-5H,6-9H2,1-3H3,(H,16,17)
InChIKeyFCKXHMQHULNNNI-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.57
Rot. Bonds3

About N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 97461841) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID97461841
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCc1ccc(CN2CCc3[nH]nc(C(=O)N(C)C)c3C2)o1
InChIInChI=1S/C15H20N4O2/c1-10-4-5-11(21-10)8-19-7-6-13-12(9-19)14(17-16-13)15(20)18(2)3/h4-5H,6-9H2,1-3H3,(H,16,17)
InChIKeyFCKXHMQHULNNNI-UHFFFAOYSA-N
XLogP1.57
TPSA65.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (CID 97461841) is N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is Cc1ccc(CN2CCc3[nH]nc(C(=O)N(C)C)c3C2)o1.
What is the InChIKey of N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is FCKXHMQHULNNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10-4-5-11(21-10)8-19-7-6-13-12(9-19)14(17-16-13)15(20)18(2)3/h4-5H,6-9H2,1-3H3,(H,16,17).
What are the key properties of N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[(5-methylfuran-2-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 97461841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).