3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide

C11H18N2O2 — CID 60765510

IUPAC3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNCc1ccco1
InChIInChI=1S/C11H18N2O2/c1-9(2)13-11(14)5-6-12-8-10-4-3-7-15-10/h3-4,7,9,12H,5-6,8H2,1-2H3,(H,13,14)
InChIKeyLEZFFOYTCHLYHS-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.28
Rot. Bonds6

About 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide

3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide (PubChem CID 60765510) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide
PubChem CID60765510
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNCc1ccco1
InChIInChI=1S/C11H18N2O2/c1-9(2)13-11(14)5-6-12-8-10-4-3-7-15-10/h3-4,7,9,12H,5-6,8H2,1-2H3,(H,13,14)
InChIKeyLEZFFOYTCHLYHS-UHFFFAOYSA-N
XLogP1.28
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide 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-butyl-3-(furan-2-ylmethylamino)propanamide
CID 109012191
3-(furan-2-ylmethylamino)-N-propan-2-ylbutanamide
CID 115655784
1-(furan-2-ylmethyl)-3-propan-2-ylurea
CID 819269
5-[[[3-oxo-3-(propan-2-ylamino)propyl]amino]methyl]furan-2-carboxylic acid
CID 113409692
6-(furan-2-ylmethylamino)-4-methylhexanoic acid
CID 65290191
3-(furan-2-ylmethylamino)-N-prop-2-enylpropanamide
CID 109011813
N-[(2-chlorophenyl)methyl]-3-(furan-2-ylmethylamino)propanamide
CID 109018586
N-[4-(furan-2-yl)butan-2-yl]-4-(propan-2-ylamino)butanamide
CID 61249924
N-(2-bromophenyl)-3-(furan-2-ylmethylamino)propanamide
CID 109018711
4-(furan-2-ylmethylamino)butanehydrazide
CID 30031566
methyl 4-(furan-2-ylmethylamino)butanoate
CID 30403384
1-(azepan-1-yl)-3-(furan-2-ylmethylamino)propan-1-one
CID 109018638

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide (CID 60765510) is 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide is CC(C)NC(=O)CCNCc1ccco1.
What is the InChIKey of 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide?
The InChIKey is LEZFFOYTCHLYHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9(2)13-11(14)5-6-12-8-10-4-3-7-15-10/h3-4,7,9,12H,5-6,8H2,1-2H3,(H,13,14).
What are the key properties of 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide?
3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide has a molecular weight of 210.28 g/mol, XLogP of 1.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-ylmethylamino)-N-propan-2-ylpropanamide is sourced from PubChem (CID 60765510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).