N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine

C15H27N3O — CID 62436351

IUPACN-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine
SMILESCCN1CCC(N(C)Cc2cc(C)c(CN)o2)CC1
InChIInChI=1S/C15H27N3O/c1-4-18-7-5-13(6-8-18)17(3)11-14-9-12(2)15(10-16)19-14/h9,13H,4-8,10-11,16H2,1-3H3
InChIKeyVIDSROKBWPORSV-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.96
Rot. Bonds5

About N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine

N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine (PubChem CID 62436351) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine
PubChem CID62436351
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC NameN-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine
SMILESCCN1CCC(N(C)Cc2cc(C)c(CN)o2)CC1
InChIInChI=1S/C15H27N3O/c1-4-18-7-5-13(6-8-18)17(3)11-14-9-12(2)15(10-16)19-14/h9,13H,4-8,10-11,16H2,1-3H3
InChIKeyVIDSROKBWPORSV-UHFFFAOYSA-N
XLogP1.96
TPSA45.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-N-propylcyclopropanamine
CID 62422353
N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-N-ethylcyclohexanamine
CID 62423925
N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclobutyl-N-methylmethanamine
CID 62856054
N-methyl-N-[[4-methyl-5-(methylaminomethyl)furan-2-yl]methyl]cyclohexanamine
CID 62424078
N-[[2-(aminomethyl)-4-pyridinyl]methyl]-1-ethyl-N-methylpiperidin-4-amine
CID 63887860
[3-methyl-5-[(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methyl]furan-2-yl]methanamine
CID 79170378
N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62418553
1-N-(1-ethylpiperidin-4-yl)-1-N,4-dimethylbenzene-1,3-diamine
CID 62912336
[5-[(4-ethyl-3-methylpiperazin-1-yl)methyl]-3-methylfuran-2-yl]methanamine
CID 55217384
ethane;N'-(1-ethylpiperidin-4-yl)-N'-methylmethanediamine
CID 142615692
N-[(2-amino-5-fluorophenyl)methyl]-1-ethyl-N-methylpiperidin-4-amine
CID 55004343
N-[[4-(aminomethyl)-5-methylfuran-2-yl]methyl]-N-methylcycloheptanamine
CID 55073900

Frequently Asked Questions

What is the IUPAC name of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine?
The IUPAC name of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine (CID 62436351) is N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine.
What is the SMILES notation for N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine?
The canonical SMILES for N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine is CCN1CCC(N(C)Cc2cc(C)c(CN)o2)CC1.
What is the InChIKey of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine?
The InChIKey is VIDSROKBWPORSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-4-18-7-5-13(6-8-18)17(3)11-14-9-12(2)15(10-16)19-14/h9,13H,4-8,10-11,16H2,1-3H3.
What are the key properties of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine?
N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine has a molecular weight of 265.40 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-ethyl-N-methylpiperidin-4-amine is sourced from PubChem (CID 62436351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).