2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid

C14H24N2O4 — CID 63876981

IUPAC2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid
SMILESCC1CC1CN(C)C(=O)N1CCC(OCC(=O)O)CC1
InChIInChI=1S/C14H24N2O4/c1-10-7-11(10)8-15(2)14(19)16-5-3-12(4-6-16)20-9-13(17)18/h10-12H,3-9H2,1-2H3,(H,17,18)
InChIKeyGDCDKUDNDJTVGU-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.26
Rot. Bonds5

About 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid

2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid (PubChem CID 63876981) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid.

Molecular Properties

Compound Name2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid
PubChem CID63876981
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid
SMILESCC1CC1CN(C)C(=O)N1CCC(OCC(=O)O)CC1
InChIInChI=1S/C14H24N2O4/c1-10-7-11(10)8-15(2)14(19)16-5-3-12(4-6-16)20-9-13(17)18/h10-12H,3-9H2,1-2H3,(H,17,18)
InChIKeyGDCDKUDNDJTVGU-UHFFFAOYSA-N
XLogP1.26
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[[2-(dimethylamino)-2-oxoethyl]-methylcarbamoyl]piperidin-4-yl]oxyacetic acid
CID 63875757
2-[1-[(2-methoxy-2-oxoethyl)-methylcarbamoyl]piperidin-4-yl]oxyacetic acid
CID 63877473
2-[1-[(3-methoxy-3-oxopropyl)-methylcarbamoyl]piperidin-4-yl]oxyacetic acid
CID 63875250
3-[1-[cyclobutylmethyl(methyl)carbamoyl]piperidin-4-yl]oxypropanoic acid
CID 63876978
2-[1-[methyl(1H-1,2,4-triazol-5-ylmethyl)carbamoyl]piperidin-4-yl]oxyacetic acid
CID 64517526
2-[1-[2-methoxyethyl(propan-2-yl)carbamoyl]piperidin-4-yl]oxyacetic acid
CID 82939729
2-[1-[4-(dimethylamino)butan-2-ylcarbamoyl]piperidin-4-yl]oxyacetic acid
CID 63876453
2-[(3R)-1-[methyl(2-phenylethyl)carbamoyl]pyrrolidin-3-yl]oxyacetic acid
CID 166263459
2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]pyrrolidin-2-yl]acetic acid
CID 55257886
2-[(3S)-1-acetylpyrrolidin-3-yl]oxyacetic acid
CID 66563754
2-(1-prop-2-enoylpiperidin-4-yl)oxyacetic acid
CID 63869209
3-[(4-methoxypiperidine-1-carbonyl)-methylamino]propanoic acid
CID 61199548

Frequently Asked Questions

What is the IUPAC name of 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid?
The IUPAC name of 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid (CID 63876981) is 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid.
What is the SMILES notation for 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid?
The canonical SMILES for 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid is CC1CC1CN(C)C(=O)N1CCC(OCC(=O)O)CC1.
What is the InChIKey of 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid?
The InChIKey is GDCDKUDNDJTVGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-10-7-11(10)8-15(2)14(19)16-5-3-12(4-6-16)20-9-13(17)18/h10-12H,3-9H2,1-2H3,(H,17,18).
What are the key properties of 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid?
2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid has a molecular weight of 284.36 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[methyl-[(2-methylcyclopropyl)methyl]carbamoyl]piperidin-4-yl]oxyacetic acid is sourced from PubChem (CID 63876981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).