N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide

C23H27N3O2 — CID 92614643

IUPACN-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1cccn2cc(C(=O)N(Cc3ccccc3)[C@@H]3CCOC(C)(C)C3)nc12
InChIInChI=1S/C23H27N3O2/c1-17-8-7-12-25-16-20(24-21(17)25)22(27)26(15-18-9-5-4-6-10-18)19-11-13-28-23(2,3)14-19/h4-10,12,16,19H,11,13-15H2,1-3H3/t19-/m1/s1
InChIKeyLYAYQQOGHUUORV-LJQANCHMSA-N
MW377.49 g/mol
LogP4.24
Rot. Bonds4

About N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide

N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 92614643) has the molecular formula C23H27N3O2 and a molecular weight of 377.49 g/mol. Its IUPAC name is N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID92614643
Molecular FormulaC23H27N3O2
Molecular Weight377.49 g/mol
Exact Mass377.21
IUPAC NameN-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1cccn2cc(C(=O)N(Cc3ccccc3)[C@@H]3CCOC(C)(C)C3)nc12
InChIInChI=1S/C23H27N3O2/c1-17-8-7-12-25-16-20(24-21(17)25)22(27)26(15-18-9-5-4-6-10-18)19-11-13-28-23(2,3)14-19/h4-10,12,16,19H,11,13-15H2,1-3H3/t19-/m1/s1
InChIKeyLYAYQQOGHUUORV-LJQANCHMSA-N
XLogP4.24
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 138058367
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N-[(4R)-2,2-dimethyloxan-4-yl]-N-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxamide
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N-[(4R)-2,2-dimethyloxan-4-yl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide
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2-chloro-N-(2,2-dimethyloxan-4-yl)-N-[(3-ethylphenyl)methyl]acetamide
CID 166418440
N-benzyl-6-bromo-N-cyclopropylpyridine-2-carboxamide
CID 103874221
N-benzyl-2,2-dimethyl-N-(2-phenylethyl)oxan-4-amine chloride
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2-anilino-N-[(4S)-2,2-dimethyloxan-4-yl]-N-ethylpyrimidine-5-carboxamide
CID 97149283
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2-[(2,2-dimethyloxan-4-yl)-methylamino]acetic acid
CID 65056592
N-(2-hydroxyethyl)-8-methyl-N-(1,3-thiazol-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 92614643) is N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide is Cc1cccn2cc(C(=O)N(Cc3ccccc3)[C@@H]3CCOC(C)(C)C3)nc12.
What is the InChIKey of N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is LYAYQQOGHUUORV-LJQANCHMSA-N. The full InChI is InChI=1S/C23H27N3O2/c1-17-8-7-12-25-16-20(24-21(17)25)22(27)26(15-18-9-5-4-6-10-18)19-11-13-28-23(2,3)14-19/h4-10,12,16,19H,11,13-15H2,1-3H3/t19-/m1/s1.
What are the key properties of N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 377.49 g/mol, XLogP of 4.24, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[(4R)-2,2-dimethyloxan-4-yl]-8-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 92614643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).