N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

C14H17N3O3 — CID 62359400

IUPACN-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCc1noc2ncc(C(=O)NC3CCCCC3O)cc12
InChIInChI=1S/C14H17N3O3/c1-8-10-6-9(7-15-14(10)20-17-8)13(19)16-11-4-2-3-5-12(11)18/h6-7,11-12,18H,2-5H2,1H3,(H,16,19)
InChIKeyLKNCTONYPZDYLD-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.56
Rot. Bonds2

About N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (PubChem CID 62359400) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
PubChem CID62359400
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC NameN-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
SMILESCc1noc2ncc(C(=O)NC3CCCCC3O)cc12
InChIInChI=1S/C14H17N3O3/c1-8-10-6-9(7-15-14(10)20-17-8)13(19)16-11-4-2-3-5-12(11)18/h6-7,11-12,18H,2-5H2,1H3,(H,16,19)
InChIKeyLKNCTONYPZDYLD-UHFFFAOYSA-N
XLogP1.56
TPSA88.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-hydroxycyclohexyl)methyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 64927116
N-(2-hydroxycyclohexyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 62360696
N-[(1S,2S)-2-hydroxycyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 104957455
N-[1-(hydroxymethyl)cyclopropyl]-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 115764756
5-chloro-N-(2-hydroxycyclohexyl)-6-(methylamino)pyridine-3-carboxamide
CID 55063853
[(1R,2R)-2-methoxycyclohexyl] 3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxylate
CID 94797214
N-[2-(aminomethyl)cyclopentyl]-3-ethyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide;hydrochloride
CID 119600860
2-[1-[(3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carbonyl)amino]cyclobutyl]acetic acid
CID 79844219
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpyridine-4-carboxamide
CID 106753486
N-(2-amino-2-methylpropyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide;hydrochloride
CID 119627151
N-[(1S,2S)-2-hydroxycyclooctyl]-4-methyl-1,2,5-oxadiazole-3-carboxamide
CID 154563876
N-[(1S,2S)-2-hydroxycyclohexyl]-4-methyl-1,2-oxazole-5-carboxamide
CID 104956999

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide (CID 62359400) is N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is Cc1noc2ncc(C(=O)NC3CCCCC3O)cc12.
What is the InChIKey of N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
The InChIKey is LKNCTONYPZDYLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-8-10-6-9(7-15-14(10)20-17-8)13(19)16-11-4-2-3-5-12(11)18/h6-7,11-12,18H,2-5H2,1H3,(H,16,19).
What are the key properties of N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide?
N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide has a molecular weight of 275.31 g/mol, XLogP of 1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 62359400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).