(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide

C9H14N2O2 — CID 78973579

IUPAC(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide
SMILESC[C@@H](N)C(=O)N(C)Cc1ccoc1
InChIInChI=1S/C9H14N2O2/c1-7(10)9(12)11(2)5-8-3-4-13-6-8/h3-4,6-7H,5,10H2,1-2H3/t7-/m1/s1
InChIKeyVFDXRKRLFBESTO-SSDOTTSWSA-N
MW182.22 g/mol
LogP0.59
Rot. Bonds3

About (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide

(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide (PubChem CID 78973579) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide
PubChem CID78973579
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide
SMILESC[C@@H](N)C(=O)N(C)Cc1ccoc1
InChIInChI=1S/C9H14N2O2/c1-7(10)9(12)11(2)5-8-3-4-13-6-8/h3-4,6-7H,5,10H2,1-2H3/t7-/m1/s1
InChIKeyVFDXRKRLFBESTO-SSDOTTSWSA-N
XLogP0.59
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(furan-3-ylmethyl)-N-methyl-2-sulfanylpropanamide
CID 107024417
4-[furan-3-ylmethyl(methyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498062
4-amino-5-[furan-3-ylmethyl(methyl)amino]-5-oxopentanoic acid
CID 64890889
2-amino-N-(furan-3-ylmethyl)-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 76903871
(2S)-2-amino-N-(furan-3-ylmethyl)-3-(4-hydroxyphenyl)-N-methylpropanamide
CID 61422664
2-cyano-N-(furan-3-ylmethyl)-N,3-dimethylbutanamide
CID 55208173
N-(furan-3-ylmethyl)-N,3-dimethylbutanamide
CID 110868913
(2S)-2-amino-N-[(4-hydroxyphenyl)methyl]-N-methylpropanamide
CID 61146195
(2R)-2-amino-N-[(4-hydroxyphenyl)methyl]-N-methylpropanamide
CID 78973192
1-(furan-3-ylmethyl)-3-hydroxy-1-methylurea
CID 54330793
(2R)-2-amino-N-[(4-fluorophenyl)methyl]-N-methylpropanamide;hydrochloride
CID 119268141
4-[[2-aminopropanoyl(methyl)amino]methyl]-N-methylbenzamide
CID 54871424

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide?
The IUPAC name of (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide (CID 78973579) is (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide?
The canonical SMILES for (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide is C[C@@H](N)C(=O)N(C)Cc1ccoc1.
What is the InChIKey of (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide?
The InChIKey is VFDXRKRLFBESTO-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-7(10)9(12)11(2)5-8-3-4-13-6-8/h3-4,6-7H,5,10H2,1-2H3/t7-/m1/s1.
What are the key properties of (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide?
(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide has a molecular weight of 182.22 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide is sourced from PubChem (CID 78973579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).