6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide

C20H25N3O3 — CID 59730239

IUPAC6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(Oc2ccc(CCNC3CCC(O)CC3)cc2)nc1
InChIInChI=1S/C20H25N3O3/c21-20(25)15-3-10-19(23-13-15)26-18-8-1-14(2-9-18)11-12-22-16-4-6-17(24)7-5-16/h1-3,8-10,13,16-17,22,24H,4-7,11-12H2,(H2,21,25)
InChIKeyOYKGGIGNKWVPJE-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.41
Rot. Bonds7

About 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide

6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide (PubChem CID 59730239) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
PubChem CID59730239
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(Oc2ccc(CCNC3CCC(O)CC3)cc2)nc1
InChIInChI=1S/C20H25N3O3/c21-20(25)15-3-10-19(23-13-15)26-18-8-1-14(2-9-18)11-12-22-16-4-6-17(24)7-5-16/h1-3,8-10,13,16-17,22,24H,4-7,11-12H2,(H2,21,25)
InChIKeyOYKGGIGNKWVPJE-UHFFFAOYSA-N
XLogP2.41
TPSA97.47 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-[2-[(2-hydroxycyclopentyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68750412
6-[4-[2-[[3-[tert-butyl(dimethyl)silyl]oxycyclohexyl]amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 59730104
6-[4-[2-[[(1S,3S)-3-[tert-butyl(dimethyl)silyl]oxycyclohexyl]amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68748955
6-[4-[3-(2-phenylethylamino)propyl]phenoxy]pyridine-3-carboxamide
CID 68748065
6-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91553748
6-(4-pentylphenoxy)pyridine-3-carboxamide
CID 142415252
6-[[2-(3-phenylpropylamino)-2,3-dihydro-1H-inden-5-yl]oxy]pyridine-3-carboxamide
CID 66673399
6-[4-[2-[2-(3-chlorophenyl)ethylamino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68746071
6-[4-[2-[[4-(trifluoromethyl)phenyl]methylamino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68752063
6-[4-[2-methyl-2-(2-phenylethylamino)propyl]phenoxy]pyridine-3-carboxamide
CID 68746672
6-[[2-(2-phenylethylamino)-2,3-dihydro-1H-inden-4-yl]oxy]pyridine-3-carboxamide
CID 66673107
6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide
CID 22087205

Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
The IUPAC name of 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide (CID 59730239) is 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide is NC(=O)c1ccc(Oc2ccc(CCNC3CCC(O)CC3)cc2)nc1.
What is the InChIKey of 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
The InChIKey is OYKGGIGNKWVPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c21-20(25)15-3-10-19(23-13-15)26-18-8-1-14(2-9-18)11-12-22-16-4-6-17(24)7-5-16/h1-3,8-10,13,16-17,22,24H,4-7,11-12H2,(H2,21,25).
What are the key properties of 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.41, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 59730239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).