N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide

C13H26N2O3 — CID 114276198

IUPACN-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide
SMILESCC(C)N(CCOCCO)C(=O)C1CCCCN1
InChIInChI=1S/C13H26N2O3/c1-11(2)15(7-9-18-10-8-16)13(17)12-5-3-4-6-14-12/h11-12,14,16H,3-10H2,1-2H3
InChIKeyNKUYIQKUOLIXNO-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.37
Rot. Bonds7

About N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide

N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide (PubChem CID 114276198) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide
PubChem CID114276198
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC NameN-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide
SMILESCC(C)N(CCOCCO)C(=O)C1CCCCN1
InChIInChI=1S/C13H26N2O3/c1-11(2)15(7-9-18-10-8-16)13(17)12-5-3-4-6-14-12/h11-12,14,16H,3-10H2,1-2H3
InChIKeyNKUYIQKUOLIXNO-UHFFFAOYSA-N
XLogP0.37
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-(2-hydroxyethyl)-N-propan-2-ylpyrrolidine-2-carboxamide
CID 93173809
(2S)-N-propan-2-yl-N-propylpyrrolidine-2-carboxamide
CID 61156228
methyl 2-[propan-2-yl(pyrrolidine-2-carbonyl)amino]acetate
CID 60947765
N-propan-2-yl-N-prop-2-enylazepane-2-carboxamide
CID 64562282
(2R)-N-butan-2-yl-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
CID 103795441
2-[propan-2-yl(pyrrolidine-2-carbonyl)amino]acetic acid
CID 61159901
(2S)-N-(2-methoxyethyl)-N-pentan-3-ylpyrrolidine-2-carboxamide
CID 61163560
(2S)-N-(2-ethoxyethyl)-N-ethylpiperidine-2-carboxamide
CID 103809901
(2S)-N-cyclopropyl-N-(3-methylbutyl)piperidine-2-carboxamide
CID 93369841
N-[2-(2-bromoethoxy)ethyl]-N-propan-2-ylcycloheptanecarboxamide
CID 114276372
(2R)-N-cyclopentyl-N-(2-hydroxyethyl)piperidine-2-carboxamide
CID 104913462
N-(2-methoxyethyl)-N-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 82949267

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide?
The IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide (CID 114276198) is N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide.
What is the SMILES notation for N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide?
The canonical SMILES for N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide is CC(C)N(CCOCCO)C(=O)C1CCCCN1.
What is the InChIKey of N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide?
The InChIKey is NKUYIQKUOLIXNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-11(2)15(7-9-18-10-8-16)13(17)12-5-3-4-6-14-12/h11-12,14,16H,3-10H2,1-2H3.
What are the key properties of N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide?
N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 0.37, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethoxy)ethyl]-N-propan-2-ylpiperidine-2-carboxamide is sourced from PubChem (CID 114276198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).