trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide

C17H19N5O — CID 126810964

IUPACtrans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide
SMILESCc1cccc2nc(CNC(=O)[C@@H]3C[C@H]3c3cnn(C)c3)cn12
InChIInChI=1S/C17H19N5O/c1-11-4-3-5-16-20-13(10-22(11)16)8-18-17(23)15-6-14(15)12-7-19-21(2)9-12/h3-5,7,9-10,14-15H,6,8H2,1-2H3,(H,18,23)/t14-,15+/m0/s1
InChIKeyRDIWFJKWVOGTJS-LSDHHAIUSA-N
MW309.37 g/mol
LogP1.80
Rot. Bonds4

About trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide

trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide (PubChem CID 126810964) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Nametrans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide
PubChem CID126810964
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Nametrans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide
SMILESCc1cccc2nc(CNC(=O)[C@@H]3C[C@H]3c3cnn(C)c3)cn12
InChIInChI=1S/C17H19N5O/c1-11-4-3-5-16-20-13(10-22(11)16)8-18-17(23)15-6-14(15)12-7-19-21(2)9-12/h3-5,7,9-10,14-15H,6,8H2,1-2H3,(H,18,23)/t14-,15+/m0/s1
InChIKeyRDIWFJKWVOGTJS-LSDHHAIUSA-N
XLogP1.80
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methoxyphenyl)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]cyclopropane-1-carboxamide
CID 56785478
1-benzyl-4-[(5-methylimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]pyrrolidine-3-carboxylic acid
CID 166307697
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidine-3-carboxamide
CID 119882870
(2R,3S)-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]morpholine-3-carboxamide
CID 120941539
1-hydroxy-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]cyclopentane-1-carboxamide
CID 111112321
2-(methylamino)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide
CID 83626352
(2R)-1-benzyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]azetidine-2-carboxamide
CID 124741418
2-amino-2-methyl-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide;dihydrochloride
CID 119882818
(3R)-1-(2-methoxyethyl)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 95240355
N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
CID 166179292
N-[(6-methyl-2-pyridinyl)methyl]-2-phenylcyclopropane-1-carboxamide
CID 86841366
cis-(1R,2S)-2-(1-methylpyrazol-4-yl)-N-(9H-xanthen-9-yl)cyclopropane-1-carboxamide
CID 95307560

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide?
The IUPAC name of trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide (CID 126810964) is trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide?
The canonical SMILES for trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide is Cc1cccc2nc(CNC(=O)[C@@H]3C[C@H]3c3cnn(C)c3)cn12.
What is the InChIKey of trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide?
The InChIKey is RDIWFJKWVOGTJS-LSDHHAIUSA-N. The full InChI is InChI=1S/C17H19N5O/c1-11-4-3-5-16-20-13(10-22(11)16)8-18-17(23)15-6-14(15)12-7-19-21(2)9-12/h3-5,7,9-10,14-15H,6,8H2,1-2H3,(H,18,23)/t14-,15+/m0/s1.
What are the key properties of trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide?
trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 126810964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).