2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid

C14H24N2O3 — CID 83198884

IUPAC2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid
SMILESCC(C)(C(=O)NC(C(=O)O)C1CC1)C1CCCNC1
InChIInChI=1S/C14H24N2O3/c1-14(2,10-4-3-7-15-8-10)13(19)16-11(12(17)18)9-5-6-9/h9-11,15H,3-8H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyXXRJQCNBJXVRKK-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.99
Rot. Bonds5

About 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid

2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid (PubChem CID 83198884) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid
PubChem CID83198884
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid
SMILESCC(C)(C(=O)NC(C(=O)O)C1CC1)C1CCCNC1
InChIInChI=1S/C14H24N2O3/c1-14(2,10-4-3-7-15-8-10)13(19)16-11(12(17)18)9-5-6-9/h9-11,15H,3-8H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyXXRJQCNBJXVRKK-UHFFFAOYSA-N
XLogP0.99
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83198749
(2R)-4-amino-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]-4-oxobutanoic acid
CID 107824520
N,2-dimethyl-2-piperidin-3-ylpropanamide
CID 83031239
N',N',2-trimethyl-2-piperidin-3-ylpropanehydrazide
CID 83199911
2-methyl-3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]propanoic acid
CID 83198731
3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]hexanoic acid
CID 83200067
N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83031807
(2S)-2-cyclopropyl-2-[(2,2,2-trichloroacetyl)amino]acetic acid
CID 101214790
2-methyl-N-(2-methylpropyl)-2-piperidin-3-ylpropanamide
CID 83032464
2-methyl-N-[(1R)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylpropanamide
CID 83200384
N-cyclohexyl-2-methyl-2-piperidin-3-ylpropanamide
CID 83032368
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83200383

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid?
The IUPAC name of 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid (CID 83198884) is 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid.
What is the SMILES notation for 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid?
The canonical SMILES for 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid is CC(C)(C(=O)NC(C(=O)O)C1CC1)C1CCCNC1.
What is the InChIKey of 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid?
The InChIKey is XXRJQCNBJXVRKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-14(2,10-4-3-7-15-8-10)13(19)16-11(12(17)18)9-5-6-9/h9-11,15H,3-8H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid?
2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid has a molecular weight of 268.36 g/mol, XLogP of 0.99, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid is sourced from PubChem (CID 83198884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).