N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C18H21N3O3 — CID 50962627

IUPACN-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCC(CO)N(Cc1ccco1)C(=O)c1c(C)nc2ccccn12
InChIInChI=1S/C18H21N3O3/c1-3-14(12-22)21(11-15-7-6-10-24-15)18(23)17-13(2)19-16-8-4-5-9-20(16)17/h4-10,14,22H,3,11-12H2,1-2H3
InChIKeyUMXBOSJAKGKHQP-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.65
Rot. Bonds6

About N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide

N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 50962627) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID50962627
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC NameN-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCC(CO)N(Cc1ccco1)C(=O)c1c(C)nc2ccccn12
InChIInChI=1S/C18H21N3O3/c1-3-14(12-22)21(11-15-7-6-10-24-15)18(23)17-13(2)19-16-8-4-5-9-20(16)17/h4-10,14,22H,3,11-12H2,1-2H3
InChIKeyUMXBOSJAKGKHQP-UHFFFAOYSA-N
XLogP2.65
TPSA70.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-5-pyrrol-1-ylbenzamide
CID 95228784
N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)pyrazine-2-carboxamide
CID 45235611
N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-3-(2-methylphenyl)propanamide
CID 50964980
N-(furan-2-ylmethyl)-N-[(2S)-3-methylbutan-2-yl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 94599867
N-ethyl-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 789702
N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-3-[4-(methylamino)phenyl]benzamide
CID 118778400
N-(furan-2-ylmethyl)-N-[(2R)-1-hydroxybutan-2-yl]-3-[4-(methylamino)phenyl]benzamide
CID 125171573
N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-(1H-indol-3-yl)acetamide
CID 46994383
3-(2H-benzotriazol-5-yl)-1-(furan-2-ylmethyl)-1-[(2S)-1-hydroxybutan-2-yl]urea
CID 125155612
2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-N-(furan-2-ylmethyl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 98310107
2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-N-(furan-2-ylmethyl)-N-[(2S)-1-hydroxybutan-2-yl]acetamide
CID 98310106
N,2-dimethyl-N-prop-2-ynylimidazo[1,2-a]pyridine-3-carboxamide
CID 126470164

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 50962627) is N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide is CCC(CO)N(Cc1ccco1)C(=O)c1c(C)nc2ccccn12.
What is the InChIKey of N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is UMXBOSJAKGKHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-3-14(12-22)21(11-15-7-6-10-24-15)18(23)17-13(2)19-16-8-4-5-9-20(16)17/h4-10,14,22H,3,11-12H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 327.38 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-(1-hydroxybutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 50962627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).