1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide

C17H24N6O2 — CID 138025131

IUPAC1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide
SMILESCCn1cnc2c1CCN(C(=O)Nc1cc(C3CCCO3)nn1C)C2
InChIInChI=1S/C17H24N6O2/c1-3-22-11-18-13-10-23(7-6-14(13)22)17(24)19-16-9-12(20-21(16)2)15-5-4-8-25-15/h9,11,15H,3-8,10H2,1-2H3,(H,19,24)
InChIKeyKYIBVSKUDLUQBN-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.08
Rot. Bonds3

About 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide

1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide (PubChem CID 138025131) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide
PubChem CID138025131
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC Name1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide
SMILESCCn1cnc2c1CCN(C(=O)Nc1cc(C3CCCO3)nn1C)C2
InChIInChI=1S/C17H24N6O2/c1-3-22-11-18-13-10-23(7-6-14(13)22)17(24)19-16-9-12(20-21(16)2)15-5-4-8-25-15/h9,11,15H,3-8,10H2,1-2H3,(H,19,24)
InChIKeyKYIBVSKUDLUQBN-UHFFFAOYSA-N
XLogP2.08
TPSA77.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide?
The IUPAC name of 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide (CID 138025131) is 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide.
What is the SMILES notation for 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide?
The canonical SMILES for 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide is CCn1cnc2c1CCN(C(=O)Nc1cc(C3CCCO3)nn1C)C2.
What is the InChIKey of 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide?
The InChIKey is KYIBVSKUDLUQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-3-22-11-18-13-10-23(7-6-14(13)22)17(24)19-16-9-12(20-21(16)2)15-5-4-8-25-15/h9,11,15H,3-8,10H2,1-2H3,(H,19,24).
What are the key properties of 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide?
1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[1-methyl-3-(oxolan-2-yl)pyrazol-5-yl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide is sourced from PubChem (CID 138025131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).