N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide

C20H25N5O2 — CID 166205740

IUPACN-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NC3CCc4nc(C(C)(C)C)cn4C3)n[nH]2)o1
InChIInChI=1S/C20H25N5O2/c1-12-5-7-16(27-12)14-9-15(24-23-14)19(26)21-13-6-8-18-22-17(20(2,3)4)11-25(18)10-13/h5,7,9,11,13H,6,8,10H2,1-4H3,(H,21,26)(H,23,24)
InChIKeyUWZTXXBMTCQQQR-UHFFFAOYSA-N
MW367.45 g/mol
LogP3.22
Rot. Bonds3

About N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide

N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide (PubChem CID 166205740) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
PubChem CID166205740
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC NameN-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)NC3CCc4nc(C(C)(C)C)cn4C3)n[nH]2)o1
InChIInChI=1S/C20H25N5O2/c1-12-5-7-16(27-12)14-9-15(24-23-14)19(26)21-13-6-8-18-22-17(20(2,3)4)11-25(18)10-13/h5,7,9,11,13H,6,8,10H2,1-4H3,(H,21,26)(H,23,24)
InChIKeyUWZTXXBMTCQQQR-UHFFFAOYSA-N
XLogP3.22
TPSA88.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
The IUPAC name of N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide (CID 166205740) is N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide is Cc1ccc(-c2cc(C(=O)NC3CCc4nc(C(C)(C)C)cn4C3)n[nH]2)o1.
What is the InChIKey of N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
The InChIKey is UWZTXXBMTCQQQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c1-12-5-7-16(27-12)14-9-15(24-23-14)19(26)21-13-6-8-18-22-17(20(2,3)4)11-25(18)10-13/h5,7,9,11,13H,6,8,10H2,1-4H3,(H,21,26)(H,23,24).
What are the key properties of N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide?
N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide has a molecular weight of 367.45 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 166205740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).