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

C22H29N3O2 — CID 91471625

IUPAC6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
SMILESCCCN(CCc1ccc(Oc2ccc(C(N)=O)cn2)cc1)C1CCCC1
InChIInChI=1S/C22H29N3O2/c1-2-14-25(19-5-3-4-6-19)15-13-17-7-10-20(11-8-17)27-21-12-9-18(16-24-21)22(23)26/h7-12,16,19H,2-6,13-15H2,1H3,(H2,23,26)
InChIKeyVMZUNVNUVQDHDJ-UHFFFAOYSA-N
MW367.49 g/mol
LogP4.17
Rot. Bonds9

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

6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide (PubChem CID 91471625) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
PubChem CID91471625
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
SMILESCCCN(CCc1ccc(Oc2ccc(C(N)=O)cn2)cc1)C1CCCC1
InChIInChI=1S/C22H29N3O2/c1-2-14-25(19-5-3-4-6-19)15-13-17-7-10-20(11-8-17)27-21-12-9-18(16-24-21)22(23)26/h7-12,16,19H,2-6,13-15H2,1H3,(H2,23,26)
InChIKeyVMZUNVNUVQDHDJ-UHFFFAOYSA-N
XLogP4.17
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-pentylphenoxy)pyridine-3-carboxamide
CID 142415252
6-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91553748
6-[4-[2-[cyclohex-3-en-1-ylmethyl(methyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68750318
6-[4-[2-[(2-hydroxycyclopentyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68750412
6-[4-(9-methyl-9-bicyclo[3.3.1]nonanyl)phenoxy]pyridine-3-carboxamide
CID 146325556
6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide
CID 22087205
6-[4-[2-[(4-hydroxycyclohexyl)amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 59730239
6-[4-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]ethyl]phenoxy]pyridine-3-carboxamide
CID 68745220
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-[(2R)-2-aminopropyl]phenoxy]pyridine-3-carboxamide;hydrochloride
CID 22087128
6-[4-[2-(4-benzhydrylpiperidin-1-yl)ethyl]phenoxy]pyridine-3-carboxamide
CID 59729978

Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
The IUPAC name of 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide (CID 91471625) is 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide is CCCN(CCc1ccc(Oc2ccc(C(N)=O)cn2)cc1)C1CCCC1.
What is the InChIKey of 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
The InChIKey is VMZUNVNUVQDHDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-2-14-25(19-5-3-4-6-19)15-13-17-7-10-20(11-8-17)27-21-12-9-18(16-24-21)22(23)26/h7-12,16,19H,2-6,13-15H2,1H3,(H2,23,26).
What are the key properties of 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide?
6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide has a molecular weight of 367.49 g/mol, XLogP of 4.17, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-[cyclopentyl(propyl)amino]ethyl]phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 91471625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).