2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid

C15H22N2O2 — CID 62110488

IUPAC2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid
SMILESCCN1CCC(NC(C(=O)O)c2ccccc2)CC1
InChIInChI=1S/C15H22N2O2/c1-2-17-10-8-13(9-11-17)16-14(15(18)19)12-6-4-3-5-7-12/h3-7,13-14,16H,2,8-11H2,1H3,(H,18,19)
InChIKeyUQTUWEZXABUMBL-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.89
Rot. Bonds5

About 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid

2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid (PubChem CID 62110488) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid.

Molecular Properties

Compound Name2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid
PubChem CID62110488
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid
SMILESCCN1CCC(NC(C(=O)O)c2ccccc2)CC1
InChIInChI=1S/C15H22N2O2/c1-2-17-10-8-13(9-11-17)16-14(15(18)19)12-6-4-3-5-7-12/h3-7,13-14,16H,2,8-11H2,1H3,(H,18,19)
InChIKeyUQTUWEZXABUMBL-UHFFFAOYSA-N
XLogP1.89
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzhydryl-1-ethylpiperidin-4-amine
CID 3821522
1-ethyl-N-(1-phenylbutyl)piperidin-4-amine
CID 43224635
2-[(4-methylcycloheptyl)amino]-2-phenylacetic acid
CID 65080241
1-(1-ethylpiperidin-4-yl)-3-[(R)-phenyl(pyridin-4-yl)methyl]urea
CID 95571044
2-(cyclohex-3-en-1-ylamino)-2-phenylacetic acid
CID 103255305
(2S)-2-amino-2-phenyl-N-(1-propylpiperidin-4-yl)acetamide
CID 104897650
2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide
CID 61039141
1-(4-ethylpiperazin-1-yl)-2,2-diphenylethanone
CID 2303179
(2R)-2-phenyl-2-[[(3S)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]amino]acetamide
CID 94770337
(2S)-2-phenyl-2-[[(3R)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]amino]acetamide
CID 94770331
1-ethylpiperidin-4-ol;3-methyl-2-phenylpentanoic acid;hydrochloride
CID 21153862
2-(2-chlorophenyl)sulfanyl-N-(1-ethylpiperidin-4-yl)acetamide
CID 36810837

Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid?
The IUPAC name of 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid (CID 62110488) is 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid.
What is the SMILES notation for 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid?
The canonical SMILES for 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid is CCN1CCC(NC(C(=O)O)c2ccccc2)CC1.
What is the InChIKey of 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid?
The InChIKey is UQTUWEZXABUMBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-17-10-8-13(9-11-17)16-14(15(18)19)12-6-4-3-5-7-12/h3-7,13-14,16H,2,8-11H2,1H3,(H,18,19).
What are the key properties of 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid?
2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid has a molecular weight of 262.35 g/mol, XLogP of 1.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylpiperidin-4-yl)amino]-2-phenylacetic acid is sourced from PubChem (CID 62110488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).