N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide

C12H26N2O2 — CID 104696156

IUPACN,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide
SMILESCCN(CC)C(=O)CNC(CCO)C(C)C
InChIInChI=1S/C12H26N2O2/c1-5-14(6-2)12(16)9-13-11(7-8-15)10(3)4/h10-11,13,15H,5-9H2,1-4H3
InChIKeyRWPQAIFKAFVFPR-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.85
Rot. Bonds8

About N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide

N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide (PubChem CID 104696156) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide
PubChem CID104696156
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide
SMILESCCN(CC)C(=O)CNC(CCO)C(C)C
InChIInChI=1S/C12H26N2O2/c1-5-14(6-2)12(16)9-13-11(7-8-15)10(3)4/h10-11,13,15H,5-9H2,1-4H3
InChIKeyRWPQAIFKAFVFPR-UHFFFAOYSA-N
XLogP0.85
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-diethyl-2-[[(2S)-1-(4-fluorophenyl)-3-methylbutan-2-yl]amino]acetamide
CID 97321937
2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-pentan-2-ylacetamide
CID 104891892
2-(1-aminopropan-2-ylamino)-N,N-diethylacetamide
CID 103390839
4-methyl-3-(2-methylidenebutylamino)pentan-1-ol
CID 104892117
N,N-diethyl-2-(heptan-2-ylamino)acetamide
CID 60688008
2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methylpropyl)acetamide
CID 104696201
N,N-diethyl-2-(hexan-3-ylamino)acetamide
CID 62117829
N,N-dimethyl-2-(2-methylpentan-3-ylamino)acetamide
CID 43775382
methyl 2-[[2-(diethylamino)-2-oxoethyl]amino]-4-methylpentanoate
CID 54939870
3-[(1-hydroxy-4-methylpentan-3-yl)amino]-2,2-dimethylpropanoic acid
CID 106349473
2-[[2-(diethylamino)-2-oxoethyl]amino]-N-(2-methylbutan-2-yl)propanamide
CID 112687061
2-[[2-(diethylamino)-2-oxoethyl]amino]-N,N-diethylacetamide
CID 56638226

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide?
The IUPAC name of N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide (CID 104696156) is N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide.
What is the SMILES notation for N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide?
The canonical SMILES for N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide is CCN(CC)C(=O)CNC(CCO)C(C)C.
What is the InChIKey of N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide?
The InChIKey is RWPQAIFKAFVFPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-14(6-2)12(16)9-13-11(7-8-15)10(3)4/h10-11,13,15H,5-9H2,1-4H3.
What are the key properties of N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide?
N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide has a molecular weight of 230.35 g/mol, XLogP of 0.85, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(1-hydroxy-4-methylpentan-3-yl)amino]acetamide is sourced from PubChem (CID 104696156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).