N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide

C14H23NO4 — CID 111446484

IUPACN-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide
SMILESCCC(C)C(C)(O)CNC(=O)c1ccc(COC)o1
InChIInChI=1S/C14H23NO4/c1-5-10(2)14(3,17)9-15-13(16)12-7-6-11(19-12)8-18-4/h6-7,10,17H,5,8-9H2,1-4H3,(H,15,16)
InChIKeySBJBRXNYBFGRDX-UHFFFAOYSA-N
MW269.34 g/mol
LogP1.95
Rot. Bonds7

About N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide

N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide (PubChem CID 111446484) has the molecular formula C14H23NO4 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide
PubChem CID111446484
Molecular FormulaC14H23NO4
Molecular Weight269.34 g/mol
Exact Mass269.16
IUPAC NameN-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide
SMILESCCC(C)C(C)(O)CNC(=O)c1ccc(COC)o1
InChIInChI=1S/C14H23NO4/c1-5-10(2)14(3,17)9-15-13(16)12-7-6-11(19-12)8-18-4/h6-7,10,17H,5,8-9H2,1-4H3,(H,15,16)
InChIKeySBJBRXNYBFGRDX-UHFFFAOYSA-N
XLogP1.95
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide 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-[(2R)-2-(ethylamino)propyl]-5-(methoxymethyl)furan-2-carboxamide
CID 120650443
N-[2-(ethylamino)ethyl]-5-(methoxymethyl)furan-2-carboxamide;hydrochloride
CID 119505332
5-(methoxymethyl)-N-(7-methyloctyl)furan-2-carboxamide
CID 78847305
5-(methoxymethyl)-N-(3-propan-2-yloxypropyl)furan-2-carboxamide
CID 78827233
N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide
CID 78874120
5-chloro-N-(2-hydroxy-2,3-dimethylbutyl)furan-2-carboxamide
CID 111483845
5-(methoxymethyl)-N-[2-(methylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119500596
5-(methoxymethyl)-N-[2-oxo-2-(propylamino)ethyl]furan-2-carboxamide
CID 78827647
methyl N-[4-[[[5-(methoxymethyl)furan-2-carbonyl]amino]methyl]phenyl]carbamate
CID 78902905
1-[[4-fluoro-3-(methoxymethyl)phenyl]methyl]-3-(2-hydroxy-2,3-dimethylpentyl)urea
CID 111121249
N-[3-(aminomethyl)pentan-3-yl]-5-(methoxymethyl)furan-2-carboxamide
CID 119569164
4-N-(2-hydroxy-2,3-dimethylpentyl)benzene-1,4-dicarboxamide
CID 111463618

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide?
The IUPAC name of N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide (CID 111446484) is N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide is CCC(C)C(C)(O)CNC(=O)c1ccc(COC)o1.
What is the InChIKey of N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide?
The InChIKey is SBJBRXNYBFGRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO4/c1-5-10(2)14(3,17)9-15-13(16)12-7-6-11(19-12)8-18-4/h6-7,10,17H,5,8-9H2,1-4H3,(H,15,16).
What are the key properties of N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide?
N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide has a molecular weight of 269.34 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2,3-dimethylpentyl)-5-(methoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 111446484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).