4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid

C10H18N2O4 — CID 175395541

IUPAC4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid
SMILESCN(CCO)C(=O)C1CCN(C(=O)O)CC1
InChIInChI=1S/C10H18N2O4/c1-11(6-7-13)9(14)8-2-4-12(5-3-8)10(15)16/h8,13H,2-7H2,1H3,(H,15,16)
InChIKeyNTNQKXBDEGWZDB-UHFFFAOYSA-N
MW230.26 g/mol
LogP-0.17
Rot. Bonds3

About 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid

4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid (PubChem CID 175395541) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid
PubChem CID175395541
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid
SMILESCN(CCO)C(=O)C1CCN(C(=O)O)CC1
InChIInChI=1S/C10H18N2O4/c1-11(6-7-13)9(14)8-2-4-12(5-3-8)10(15)16/h8,13H,2-7H2,1H3,(H,15,16)
InChIKeyNTNQKXBDEGWZDB-UHFFFAOYSA-N
XLogP-0.17
TPSA81.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N,4-N-bis(2-hydroxyethyl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 61233622
3-N-(2-hydroxyethyl)-1-N,1-N,3-N-trimethylpiperidine-1,3-dicarboxamide
CID 60778381
2-[methyl-[1-(pyrrolidine-1-carbonyl)piperidine-4-carbonyl]amino]acetic acid
CID 119136399
2-[[1-(cyclopropanecarbonyl)piperidine-4-carbonyl]-methylamino]acetic acid
CID 43356245
N-(2-hydroxyethyl)-N-methyl-1-propanoylpiperidine-3-carboxamide
CID 110900000
N-butyl-1-(cyclopentanecarbonyl)-N-methylpiperidine-4-carboxamide
CID 87022999
N,N-bis(2-hydroxyethyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 61235088
4-acetylpiperidine-1-carboxylic acid
CID 22135578
N-(2-hydroxyethyl)-N-methylpiperidine-1-carboxamide
CID 68606002
piperidine-1,4-dicarboxylic acid
CID 18542445
1-acetyl-N-methyl-N-(2-morpholin-4-ylethyl)piperidine-4-carboxamide
CID 110752371
1-(2-hydroxyacetyl)-N,N-dimethylpiperidine-4-carboxamide
CID 170068801

Frequently Asked Questions

What is the IUPAC name of 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid?
The IUPAC name of 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid (CID 175395541) is 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid.
What is the SMILES notation for 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid?
The canonical SMILES for 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid is CN(CCO)C(=O)C1CCN(C(=O)O)CC1.
What is the InChIKey of 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid?
The InChIKey is NTNQKXBDEGWZDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-11(6-7-13)9(14)8-2-4-12(5-3-8)10(15)16/h8,13H,2-7H2,1H3,(H,15,16).
What are the key properties of 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid?
4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid has a molecular weight of 230.26 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-hydroxyethyl(methyl)carbamoyl]piperidine-1-carboxylic acid is sourced from PubChem (CID 175395541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).