3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide

C10H16N2O2 — CID 62524542

IUPAC3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
SMILESCc1ccc(CNC(=O)C(C)CN)o1
InChIInChI=1S/C10H16N2O2/c1-7(5-11)10(13)12-6-9-4-3-8(2)14-9/h3-4,7H,5-6,11H2,1-2H3,(H,12,13)
InChIKeyZECGDFVESNRGMK-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.80
Rot. Bonds4

About 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide

3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide (PubChem CID 62524542) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide.

Molecular Properties

Compound Name3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
PubChem CID62524542
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
SMILESCc1ccc(CNC(=O)C(C)CN)o1
InChIInChI=1S/C10H16N2O2/c1-7(5-11)10(13)12-6-9-4-3-8(2)14-9/h3-4,7H,5-6,11H2,1-2H3,(H,12,13)
InChIKeyZECGDFVESNRGMK-UHFFFAOYSA-N
XLogP0.80
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide 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

3-amino-N-[(5-methylfuran-2-yl)methyl]-2-phenylpropanamide
CID 62879092
5-amino-4-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 82012174
(2R)-2-amino-N-[(5-methylfuran-2-yl)methyl]-2-phenylacetamide
CID 55081694
2-methyl-N-[(5-methylfuran-2-yl)methyl]-3-piperazin-1-ylpropanamide
CID 115189094
3-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 110731621
3-(aminomethyl)-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 81087637
methyl 2-[(5-methylfuran-2-yl)methylamino]-2-oxoacetate
CID 112617149
(2S)-3-(4-chloro-3,5-dimethylpyrazol-1-yl)-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 39854745
(2R)-3-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 39891789
N-[(5-methylfuran-2-yl)methyl]-2-propan-2-yloxyacetamide
CID 112605133
1-(2-fluoroethyl)-3-[(5-methylfuran-2-yl)methyl]urea
CID 25119845
3-amino-2-benzyl-N-[(5-methylfuran-2-yl)methyl]-3-sulfanylidenepropanamide
CID 62524742

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide?
The IUPAC name of 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide (CID 62524542) is 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide.
What is the SMILES notation for 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide?
The canonical SMILES for 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide is Cc1ccc(CNC(=O)C(C)CN)o1.
What is the InChIKey of 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide?
The InChIKey is ZECGDFVESNRGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(5-11)10(13)12-6-9-4-3-8(2)14-9/h3-4,7H,5-6,11H2,1-2H3,(H,12,13).
What are the key properties of 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide?
3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide has a molecular weight of 196.25 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide is sourced from PubChem (CID 62524542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).