2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid

C10H18N2O3 — CID 20719689

IUPAC2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid
SMILESCN1CCC(C(=O)N(C)CC(=O)O)CC1
InChIInChI=1S/C10H18N2O3/c1-11-5-3-8(4-6-11)10(15)12(2)7-9(13)14/h8H,3-7H2,1-2H3,(H,13,14)
InChIKeyMIMJMESTZJBBSU-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.13
Rot. Bonds3

About 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid

2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid (PubChem CID 20719689) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid
PubChem CID20719689
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid
SMILESCN1CCC(C(=O)N(C)CC(=O)O)CC1
InChIInChI=1S/C10H18N2O3/c1-11-5-3-8(4-6-11)10(15)12(2)7-9(13)14/h8H,3-7H2,1-2H3,(H,13,14)
InChIKeyMIMJMESTZJBBSU-UHFFFAOYSA-N
XLogP-0.13
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-Methylbutanoyl)-4-piperidinecarboxylic acid
CID 16769238
1-(2-Methylpropanoyl)piperidine-4-carboxylic acid
CID 16770959
2-[[(4S)-1-methyl-2-oxopiperidine-4-carbonyl]-propylamino]acetic acid
CID 129384848
1-Butyrylpiperidine-4-carboxylic acid
CID 19900417
2-[[2-(4-Methylpiperidin-1-yl)-2-oxoethyl]-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258095
2-[(1-Acetylpiperidine-4-carbonyl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 79265267
(4-Carbamoyl-piperidin-1-yl)-acetic acid
CID 3159669
2(S)-(Piperidin-2-on-1-yl)-3-methylbutanoic acid
CID 15283805
1-(Dimethylaminoacetyl)piperidine-4-carboxylic acid
CID 17908774
2-[(1-Methylpiperidine-4-carbonyl)amino]propanoic acid
CID 18734979
N-[(1-methylpiperidin-4-yl)carbonyl]glycine
CID 18736333
3-Methyl-2-(2-oxopiperidin-1-yl)butanoic acid
CID 19371432

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid?
The IUPAC name of 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid (CID 20719689) is 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid is CN1CCC(C(=O)N(C)CC(=O)O)CC1.
What is the InChIKey of 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid?
The InChIKey is MIMJMESTZJBBSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-11-5-3-8(4-6-11)10(15)12(2)7-9(13)14/h8H,3-7H2,1-2H3,(H,13,14).
What are the key properties of 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid?
2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid has a molecular weight of 214.26 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(1-methylpiperidine-4-carbonyl)amino]acetic acid is sourced from PubChem (CID 20719689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).