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

C12H20N2O2 — CID 43650292

IUPAC2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide
SMILESCCCC(N)C(=O)N(C)Cc1ccc(C)o1
InChIInChI=1S/C12H20N2O2/c1-4-5-11(13)12(15)14(3)8-10-7-6-9(2)16-10/h6-7,11H,4-5,8,13H2,1-3H3
InChIKeyPNHSVHUSUFJFAO-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.67
Rot. Bonds5

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

2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide (PubChem CID 43650292) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide
PubChem CID43650292
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide
SMILESCCCC(N)C(=O)N(C)Cc1ccc(C)o1
InChIInChI=1S/C12H20N2O2/c1-4-5-11(13)12(15)14(3)8-10-7-6-9(2)16-10/h6-7,11H,4-5,8,13H2,1-3H3
InChIKeyPNHSVHUSUFJFAO-UHFFFAOYSA-N
XLogP1.67
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

(2R)-2-amino-N-[2-(dimethylamino)ethyl]-N-[(5-methylfuran-2-yl)methyl]pentanamide
CID 107569062
(2S)-2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 61146960
3-amino-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]butanamide;hydrochloride
CID 120504472
2-amino-N-(furan-2-ylmethyl)-N-methylpentanamide;hydrochloride
CID 71757104
2-amino-N,3,3-trimethyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 76893225
2-cyano-N-methyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 55208257
methyl 3-methyl-2-[methyl-[(5-methylfuran-2-yl)methyl]carbamoyl]butanoate
CID 115188077
methyl-[(5-methylfuran-2-yl)methyl]carbamothioic S-acid
CID 115170193
3-amino-1-methyl-1-[(5-methylfuran-2-yl)methyl]urea
CID 115192836
2-amino-N-[(4-methoxyphenyl)methyl]-N-methylpentanamide;hydrochloride
CID 119266470
3-amino-4-[(5-bromofuran-2-yl)methyl-methylamino]-4-oxobutanoic acid
CID 64896124
2-amino-N-[(5-bromofuran-2-yl)methyl]-N-methyl-4-methylsulfonylbutanamide
CID 54873405

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide?
The IUPAC name of 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide (CID 43650292) is 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide.
What is the SMILES notation for 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide?
The canonical SMILES for 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide is CCCC(N)C(=O)N(C)Cc1ccc(C)o1.
What is the InChIKey of 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide?
The InChIKey is PNHSVHUSUFJFAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-4-5-11(13)12(15)14(3)8-10-7-6-9(2)16-10/h6-7,11H,4-5,8,13H2,1-3H3.
What are the key properties of 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide?
2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide has a molecular weight of 224.30 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pentanamide is sourced from PubChem (CID 43650292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).