N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine

C14H26N2O — CID 55074909

IUPACN-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine
SMILESCCCC(C)N(C)Cc1cc(CNCC)co1
InChIInChI=1S/C14H26N2O/c1-5-7-12(3)16(4)10-14-8-13(11-17-14)9-15-6-2/h8,11-12,15H,5-7,9-10H2,1-4H3
InChIKeyPGXAXVVCXKUOIK-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.01
Rot. Bonds8

About N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine

N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine (PubChem CID 55074909) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine.

Molecular Properties

Compound NameN-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine
PubChem CID55074909
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine
SMILESCCCC(C)N(C)Cc1cc(CNCC)co1
InChIInChI=1S/C14H26N2O/c1-5-7-12(3)16(4)10-14-8-13(11-17-14)9-15-6-2/h8,11-12,15H,5-7,9-10H2,1-4H3
InChIKeyPGXAXVVCXKUOIK-UHFFFAOYSA-N
XLogP3.01
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine with MolForge

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Related Compounds

N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N,3-dimethylbutan-2-amine
CID 62433190
N-methyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]butan-2-amine
CID 62419547
N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-2-methoxy-N-methylpropan-1-amine
CID 112754632
N,4-dimethyl-N-[[4-(methylaminomethyl)furan-2-yl]methyl]pentan-2-amine
CID 62463388
N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N,2-dimethylcyclohexan-1-amine
CID 55072095
N-[[5-[[cyclopropylmethyl(ethyl)amino]methyl]furan-3-yl]methyl]ethanamine
CID 63940661
N-[[5-[[ethyl(2-methylprop-2-enyl)amino]methyl]furan-3-yl]methyl]-2-methylpropan-1-amine
CID 62417078
N-[[4-[(tert-butylamino)methyl]furan-2-yl]methyl]-N,3,3-trimethylbutan-2-amine
CID 62426679
N-[[5-[[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]methyl]furan-3-yl]methyl]ethanamine
CID 63838094
N-ethyl-2-methyl-N-[[4-(propylaminomethyl)furan-2-yl]methyl]prop-2-en-1-amine
CID 62419772
N,2-dimethyl-N-[[4-(propylaminomethyl)furan-2-yl]methyl]butan-2-amine
CID 63967204
N-(3-methylbutyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine
CID 78990027

Frequently Asked Questions

What is the IUPAC name of N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine?
The IUPAC name of N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine (CID 55074909) is N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine.
What is the SMILES notation for N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine?
The canonical SMILES for N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine is CCCC(C)N(C)Cc1cc(CNCC)co1.
What is the InChIKey of N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine?
The InChIKey is PGXAXVVCXKUOIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-5-7-12(3)16(4)10-14-8-13(11-17-14)9-15-6-2/h8,11-12,15H,5-7,9-10H2,1-4H3.
What are the key properties of N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine?
N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine has a molecular weight of 238.37 g/mol, XLogP of 3.01, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(ethylaminomethyl)furan-2-yl]methyl]-N-methylpentan-2-amine is sourced from PubChem (CID 55074909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).