N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide

C10H21NO3 — CID 114875395

IUPACN-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide
SMILESCCC(C)CC(=O)NCCOCCO
InChIInChI=1S/C10H21NO3/c1-3-9(2)8-10(13)11-4-6-14-7-5-12/h9,12H,3-8H2,1-2H3,(H,11,13)
InChIKeyOWAYUZDXVNRTCQ-UHFFFAOYSA-N
MW203.28 g/mol
LogP0.55
Rot. Bonds8

About N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide

N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide (PubChem CID 114875395) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide
PubChem CID114875395
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC NameN-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide
SMILESCCC(C)CC(=O)NCCOCCO
InChIInChI=1S/C10H21NO3/c1-3-9(2)8-10(13)11-4-6-14-7-5-12/h9,12H,3-8H2,1-2H3,(H,11,13)
InChIKeyOWAYUZDXVNRTCQ-UHFFFAOYSA-N
XLogP0.55
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-bromoethoxy)ethyl]-3-methylpentanamide
CID 114876985
(3R)-N-(3-hydroxypropyl)-3-methylpentanamide
CID 173107720
N-[2-(2-hydroxyethoxy)ethyl]-3,4,4-trimethylpentanamide
CID 63832411
3-methyl-N-[2-oxo-2-[2-[2-[2-[2-(3-oxopropoxy)ethoxy]ethoxy]ethoxy]ethylamino]ethyl]pentanamide
CID 145418064
3-methyl-N-[2-[2-[2-[3-(4-methylpentylamino)-3-oxopropoxy]ethoxy]ethoxy]ethyl]pentanamide
CID 168959082
3-methyl-N-[2-[2-[2-[2-(3-methylbutanoylamino)ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 166662987
2,4-diethyl-N,N'-bis[2-(2-hydroxyethoxy)ethyl]pentanediamide
CID 89382356
4-hydroxy-N-[2-[2-(4-methylhexoxy)ethoxy]ethyl]butanamide
CID 163400778
2-amino-N-[2-(2-hydroxyethoxy)ethyl]butanamide
CID 61273537
N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]-3-(2-methylpropylamino)-4-oxopentanamide
CID 174287270
2-amino-N-[2-(2-hydroxyethoxy)ethyl]propanamide
CID 61275223
N-(2-ethoxyethyl)-3-methylbutanamide
CID 58439580

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide?
The IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide (CID 114875395) is N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide.
What is the SMILES notation for N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide?
The canonical SMILES for N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide is CCC(C)CC(=O)NCCOCCO.
What is the InChIKey of N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide?
The InChIKey is OWAYUZDXVNRTCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-3-9(2)8-10(13)11-4-6-14-7-5-12/h9,12H,3-8H2,1-2H3,(H,11,13).
What are the key properties of N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide?
N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide has a molecular weight of 203.28 g/mol, XLogP of 0.55, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethoxy)ethyl]-3-methylpentanamide is sourced from PubChem (CID 114875395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).