(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide

C13H22N2O2 — CID 103950106

IUPAC(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide
SMILESCCCC[C@H](N)C(=O)NC(C)Cc1ccco1
InChIInChI=1S/C13H22N2O2/c1-3-4-7-12(14)13(16)15-10(2)9-11-6-5-8-17-11/h5-6,8,10,12H,3-4,7,9,14H2,1-2H3,(H,15,16)/t10?,12-/m0/s1
InChIKeyDFENHNGYLNHBMM-KFJBMODSSA-N
MW238.33 g/mol
LogP1.84
Rot. Bonds7

About (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide

(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide (PubChem CID 103950106) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide
PubChem CID103950106
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide
SMILESCCCC[C@H](N)C(=O)NC(C)Cc1ccco1
InChIInChI=1S/C13H22N2O2/c1-3-4-7-12(14)13(16)15-10(2)9-11-6-5-8-17-11/h5-6,8,10,12H,3-4,7,9,14H2,1-2H3,(H,15,16)/t10?,12-/m0/s1
InChIKeyDFENHNGYLNHBMM-KFJBMODSSA-N
XLogP1.84
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide 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

2-amino-N-[1-(furan-2-yl)propan-2-yl]pentanamide
CID 43705248
2-amino-N-[(1R)-1-(furan-2-yl)ethyl]hexanamide
CID 81399941
2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide
CID 81088081
3-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-methylpropanamide
CID 62728492
2-amino-N-[1-(furan-2-yl)propan-2-yl]-2-thiophen-2-ylacetamide
CID 113279094
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-methylsulfonylpropanamide
CID 94171682
2-amino-N-[1-(3-chlorophenyl)propan-2-yl]hexanamide
CID 60854385
(2S)-2-amino-N-[1-(furan-2-yl)ethyl]pentanamide
CID 107568236
ethyl 2-amino-3-(furan-2-yl)propanoate
CID 22608494
(2S)-2-amino-N-ethyl-N-(furan-2-ylmethyl)hexanamide
CID 113357146
N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47148390
1-(furan-2-yl)hexan-2-ol
CID 83171633

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide?
The IUPAC name of (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide (CID 103950106) is (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide.
What is the SMILES notation for (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide?
The canonical SMILES for (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide is CCCC[C@H](N)C(=O)NC(C)Cc1ccco1.
What is the InChIKey of (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide?
The InChIKey is DFENHNGYLNHBMM-KFJBMODSSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-3-4-7-12(14)13(16)15-10(2)9-11-6-5-8-17-11/h5-6,8,10,12H,3-4,7,9,14H2,1-2H3,(H,15,16)/t10?,12-/m0/s1.
What are the key properties of (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide?
(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide has a molecular weight of 238.33 g/mol, XLogP of 1.84, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide is sourced from PubChem (CID 103950106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).