2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid

C17H24N2O3 — CID 2738329

IUPAC2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid
SMILESCCc1ccnc(NC(=O)CC2(CC(=O)O)CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-2-13-6-9-18-14(10-13)19-15(20)11-17(12-16(21)22)7-4-3-5-8-17/h6,9-10H,2-5,7-8,11-12H2,1H3,(H,21,22)(H,18,19,20)
InChIKeyFWJWUOOIZFFXQC-UHFFFAOYSA-N
MW304.39 g/mol
LogP3.40
Rot. Bonds6

About 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid

2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid (PubChem CID 2738329) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid.

Molecular Properties

Compound Name2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid
PubChem CID2738329
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid
SMILESCCc1ccnc(NC(=O)CC2(CC(=O)O)CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-2-13-6-9-18-14(10-13)19-15(20)11-17(12-16(21)22)7-4-3-5-8-17/h6,9-10H,2-5,7-8,11-12H2,1H3,(H,21,22)(H,18,19,20)
InChIKeyFWJWUOOIZFFXQC-UHFFFAOYSA-N
XLogP3.40
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid with MolForge

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Related Compounds

2-[1-(aminomethyl)cyclohexyl]-N-(4-methyl-2-pyridinyl)acetamide
CID 104677502
5-[(4-ethyl-2-pyridinyl)amino]-5-oxopentanoic acid
CID 2812026
2-[1-[2-oxo-2-(pyridazin-3-ylamino)ethyl]cyclopentyl]acetic acid
CID 116786341
2-[1-[2-[(4,6-dimethyl-2-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 114931870
N-(4-ethyl-2-pyridinyl)cyclopropanecarboxamide
CID 89291693
2-[1-[2-(2-ethoxyanilino)-2-oxoethyl]cyclohexyl]acetic acid
CID 31616843
2-[1-[2-[4-(methylcarbamoyl)anilino]-2-oxoethyl]cyclohexyl]acetic acid
CID 31616634
2-[1-[2-[(3-chloro-2-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 103094005
2-[1-[2-[(3-methyl-4-pyridinyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 63671201
2-[1-[2-(4-chloro-3-methoxycarbonylanilino)-2-oxoethyl]cyclohexyl]acetic acid
CID 56807913
2-[1-[2-[(3-methyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 65486610
2-[1-[2-(3-iodo-4-methylanilino)-2-oxoethyl]cyclopentyl]acetic acid
CID 60662784

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid?
The IUPAC name of 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid (CID 2738329) is 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid.
What is the SMILES notation for 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid?
The canonical SMILES for 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid is CCc1ccnc(NC(=O)CC2(CC(=O)O)CCCCC2)c1.
What is the InChIKey of 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid?
The InChIKey is FWJWUOOIZFFXQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-2-13-6-9-18-14(10-13)19-15(20)11-17(12-16(21)22)7-4-3-5-8-17/h6,9-10H,2-5,7-8,11-12H2,1H3,(H,21,22)(H,18,19,20).
What are the key properties of 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid?
2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid has a molecular weight of 304.39 g/mol, XLogP of 3.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-[(4-ethyl-2-pyridinyl)amino]-2-oxoethyl]cyclohexyl]acetic acid is sourced from PubChem (CID 2738329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).