2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid

C15H26N2O3 — CID 61159791

IUPAC2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid
SMILESO=C(CC1CCNCC1)NC(C(=O)O)C1CCCCC1
InChIInChI=1S/C15H26N2O3/c18-13(10-11-6-8-16-9-7-11)17-14(15(19)20)12-4-2-1-3-5-12/h11-12,14,16H,1-10H2,(H,17,18)(H,19,20)
InChIKeyMEFXZYMJUBLMJI-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.53
Rot. Bonds5

About 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid

2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid (PubChem CID 61159791) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid.

Molecular Properties

Compound Name2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid
PubChem CID61159791
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid
SMILESO=C(CC1CCNCC1)NC(C(=O)O)C1CCCCC1
InChIInChI=1S/C15H26N2O3/c18-13(10-11-6-8-16-9-7-11)17-14(15(19)20)12-4-2-1-3-5-12/h11-12,14,16H,1-10H2,(H,17,18)(H,19,20)
InChIKeyMEFXZYMJUBLMJI-UHFFFAOYSA-N
XLogP1.53
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-2-[(2-piperidin-4-ylacetyl)amino]propanoic acid
CID 61157563
(2S)-2-cyclohexyl-2-(piperidin-4-ylamino)acetic acid;dihydrochloride
CID 68649857
2-cyclohexyl-2-[[2-(3-methylazetidin-3-yl)oxyacetyl]amino]acetic acid
CID 102656029
2-cycloheptyl-N-(piperidin-4-ylmethyl)acetamide
CID 115736681
(2R)-3-hydroxy-2-[(2-pyrrolidin-3-ylacetyl)amino]propanoic acid
CID 80750139
(2S)-5-amino-5-oxo-2-[(2-piperidin-4-ylacetyl)amino]pentanoic acid
CID 61160975
2-cycloheptyl-N-(1-piperidin-3-ylethyl)acetamide
CID 115736930
(2S)-2-[(2-cyclohexylacetyl)amino]propanoic acid
CID 51604978
N-(4-hydroxybutan-2-yl)-2-piperidin-4-ylacetamide
CID 83177313
N-(4-methylpentan-2-yl)-2-piperidin-4-ylacetamide
CID 43372444
2-cyclohexyl-2-[[2-(1-methoxycyclobutyl)acetyl]amino]acetic acid
CID 103555560
2-cyclopropyl-2-[(2-morpholin-2-ylacetyl)amino]acetic acid
CID 66427040

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid?
The IUPAC name of 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid (CID 61159791) is 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid.
What is the SMILES notation for 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid?
The canonical SMILES for 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid is O=C(CC1CCNCC1)NC(C(=O)O)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid?
The InChIKey is MEFXZYMJUBLMJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c18-13(10-11-6-8-16-9-7-11)17-14(15(19)20)12-4-2-1-3-5-12/h11-12,14,16H,1-10H2,(H,17,18)(H,19,20).
What are the key properties of 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid?
2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid has a molecular weight of 282.38 g/mol, XLogP of 1.53, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-[(2-piperidin-4-ylacetyl)amino]acetic acid is sourced from PubChem (CID 61159791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).