N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine

C11H19N3O — CID 115229932

IUPACN,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine
SMILESCc1ccc(N(C)CN2CCNCC2)o1
InChIInChI=1S/C11H19N3O/c1-10-3-4-11(15-10)13(2)9-14-7-5-12-6-8-14/h3-4,12H,5-9H2,1-2H3
InChIKeyZZGLHUHVSYLDAJ-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.89
Rot. Bonds3

About N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine

N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine (PubChem CID 115229932) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine.

Molecular Properties

Compound NameN,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine
PubChem CID115229932
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine
SMILESCc1ccc(N(C)CN2CCNCC2)o1
InChIInChI=1S/C11H19N3O/c1-10-3-4-11(15-10)13(2)9-14-7-5-12-6-8-14/h3-4,12H,5-9H2,1-2H3
InChIKeyZZGLHUHVSYLDAJ-UHFFFAOYSA-N
XLogP0.89
TPSA31.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N,5-dimethylfuran-2-amine
CID 115255275
4-bromo-N-methyl-N-(piperazin-1-ylmethyl)aniline
CID 115229855
1-[3-(5-methylfuran-2-yl)propyl]piperazine
CID 82161568
5-chloro-N-methyl-N-(piperazin-1-ylmethyl)thiophen-2-amine
CID 115229873
1-(5-methylfuran-2-yl)-2-piperazin-1-ylethanol
CID 3494816
1-[4-(5-methylfuran-2-yl)butyl]piperazine
CID 116928635
N,5-dimethyl-N-[2-(4-methylpiperazin-2-yl)ethyl]furan-2-amine
CID 115239392
N-methyl-N-[(5-methylfuran-2-yl)methyl]-3-piperazin-1-ylpropanamide
CID 115171782
1-[2-methyl-3-(5-methylfuran-2-yl)propyl]piperazine
CID 116931937
N-methyl-1-(4-methylphenyl)-N-(piperazin-1-ylmethyl)methanamine
CID 115230053
N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]-2-piperazin-1-ylpropan-1-amine
CID 80551355
N-methyl-N-(5-methylfuran-2-yl)-2-(1-methylpiperazin-2-yl)acetamide
CID 115178391

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine?
The IUPAC name of N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine (CID 115229932) is N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine.
What is the SMILES notation for N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine?
The canonical SMILES for N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine is Cc1ccc(N(C)CN2CCNCC2)o1.
What is the InChIKey of N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine?
The InChIKey is ZZGLHUHVSYLDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-10-3-4-11(15-10)13(2)9-14-7-5-12-6-8-14/h3-4,12H,5-9H2,1-2H3.
What are the key properties of N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine?
N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine has a molecular weight of 209.29 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-(piperazin-1-ylmethyl)furan-2-amine is sourced from PubChem (CID 115229932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).