7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide

C18H25N3O2 — CID 52530334

IUPAC7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccn2cc(C(=O)NCCO[C@@H]3CCCC[C@@H]3C)nc2c1
InChIInChI=1S/C18H25N3O2/c1-13-7-9-21-12-15(20-17(21)11-13)18(22)19-8-10-23-16-6-4-3-5-14(16)2/h7,9,11-12,14,16H,3-6,8,10H2,1-2H3,(H,19,22)/t14-,16+/m0/s1
InChIKeyHDVYMCGOIWJDHU-GOEBONIOSA-N
MW315.42 g/mol
LogP2.97
Rot. Bonds5

About 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide

7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 52530334) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID52530334
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccn2cc(C(=O)NCCO[C@@H]3CCCC[C@@H]3C)nc2c1
InChIInChI=1S/C18H25N3O2/c1-13-7-9-21-12-15(20-17(21)11-13)18(22)19-8-10-23-16-6-4-3-5-14(16)2/h7,9,11-12,14,16H,3-6,8,10H2,1-2H3,(H,19,22)/t14-,16+/m0/s1
InChIKeyHDVYMCGOIWJDHU-GOEBONIOSA-N
XLogP2.97
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide with MolForge

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Related Compounds

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N-[[1-[(1-hydroxycyclohexyl)methyl]piperidin-4-yl]methyl]-2-propan-2-ylimidazo[1,2-a]pyridine-8-carboxamide
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3,7-Bis(2-methylpropyl)-8-pyridin-3-ylpurine-2,6-dione
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N-(1,2,3,4-tetrahydronaphthalen-1-yl)imidazo[1,2-a]pyridine-2-carboxamide
CID 4880003
1-Benzyl-3-isobutyl-1H-1,3,4b,9-tetraaza-fluorene-2,4-dione
CID 11046285
1-Benzyl-3-ethyl-1H-1,3,4b,9-tetraaza-fluorene-2,4-dione
CID 11056301
1-Benzyl-8-tert-butylpurino[7,8-a]pyridine-2,4-dione
CID 44341299
N-benzyl-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 881566

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 52530334) is 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide is Cc1ccn2cc(C(=O)NCCO[C@@H]3CCCC[C@@H]3C)nc2c1.
What is the InChIKey of 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is HDVYMCGOIWJDHU-GOEBONIOSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-13-7-9-21-12-15(20-17(21)11-13)18(22)19-8-10-23-16-6-4-3-5-14(16)2/h7,9,11-12,14,16H,3-6,8,10H2,1-2H3,(H,19,22)/t14-,16+/m0/s1.
What are the key properties of 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide?
7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[2-[(1R,2S)-2-methylcyclohexyl]oxyethyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 52530334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).