2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide

C19H28N2O4 — CID 126773213

IUPAC2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide
SMILESO=C(NCC1(CCO)CCOC1)c1ccnc(OC2CCCCC2)c1
InChIInChI=1S/C19H28N2O4/c22-10-7-19(8-11-24-14-19)13-21-18(23)15-6-9-20-17(12-15)25-16-4-2-1-3-5-16/h6,9,12,16,22H,1-5,7-8,10-11,13-14H2,(H,21,23)
InChIKeyPLJZPHUKHHQUBJ-UHFFFAOYSA-N
MW348.44 g/mol
LogP2.31
Rot. Bonds7

About 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide

2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide (PubChem CID 126773213) has the molecular formula C19H28N2O4 and a molecular weight of 348.44 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide
PubChem CID126773213
Molecular FormulaC19H28N2O4
Molecular Weight348.44 g/mol
Exact Mass348.20
IUPAC Name2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide
SMILESO=C(NCC1(CCO)CCOC1)c1ccnc(OC2CCCCC2)c1
InChIInChI=1S/C19H28N2O4/c22-10-7-19(8-11-24-14-19)13-21-18(23)15-6-9-20-17(12-15)25-16-4-2-1-3-5-16/h6,9,12,16,22H,1-5,7-8,10-11,13-14H2,(H,21,23)
InChIKeyPLJZPHUKHHQUBJ-UHFFFAOYSA-N
XLogP2.31
TPSA80.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.44
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2-cyclobutyloxypyridine-4-carbonyl)amino]oxolane-3-carboxylic acid
CID 120532705
N-cyclododecyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 121160706
N-cyclohexyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815236
2-cyclopentyloxy-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide
CID 91815463
N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]-2-sulfanylidene-3H-1,3-benzoxazole-6-carboxamide
CID 102559766
2-cyclopentyloxy-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 91815462
N-[3-(dimethylamino)propyl]-2-[(3S)-oxolan-3-yl]oxypyridine-4-carboxamide
CID 124617634
N-[3-(dimethylamino)propyl]-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815235
4-[2-[(2-cyclobutyloxypyridine-4-carbonyl)amino]ethyl]benzoic acid
CID 120512957
N-(3,3-diphenylpropyl)-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 91815243
N-methyl-2-(oxolan-3-yloxy)pyridine-4-carboxamide
CID 75504581
N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide
CID 126802993

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide?
The IUPAC name of 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide (CID 126773213) is 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide is O=C(NCC1(CCO)CCOC1)c1ccnc(OC2CCCCC2)c1.
What is the InChIKey of 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide?
The InChIKey is PLJZPHUKHHQUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4/c22-10-7-19(8-11-24-14-19)13-21-18(23)15-6-9-20-17(12-15)25-16-4-2-1-3-5-16/h6,9,12,16,22H,1-5,7-8,10-11,13-14H2,(H,21,23).
What are the key properties of 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide?
2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide has a molecular weight of 348.44 g/mol, XLogP of 2.31, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-[[3-(2-hydroxyethyl)oxolan-3-yl]methyl]pyridine-4-carboxamide is sourced from PubChem (CID 126773213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).