N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine

C12H27N3 — CID 115239559

IUPACN,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine
SMILESCC(C)CN(C)CCC1CNCCN1C
InChIInChI=1S/C12H27N3/c1-11(2)10-14(3)7-5-12-9-13-6-8-15(12)4/h11-13H,5-10H2,1-4H3
InChIKeyWUGGTWKESDVVFS-UHFFFAOYSA-N
MW213.37 g/mol
LogP0.87
Rot. Bonds5

About N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine

N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine (PubChem CID 115239559) has the molecular formula C12H27N3 and a molecular weight of 213.37 g/mol. Its IUPAC name is N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine
PubChem CID115239559
Molecular FormulaC12H27N3
Molecular Weight213.37 g/mol
Exact Mass213.22
IUPAC NameN,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine
SMILESCC(C)CN(C)CCC1CNCCN1C
InChIInChI=1S/C12H27N3/c1-11(2)10-14(3)7-5-12-9-13-6-8-15(12)4/h11-13H,5-10H2,1-4H3
InChIKeyWUGGTWKESDVVFS-UHFFFAOYSA-N
XLogP0.87
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.37
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine 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,3-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]butan-1-amine
CID 115239639
N-methyl-2-(1-methylpiperazin-2-yl)-N-(pyridin-4-ylmethyl)ethanamine
CID 115239656
N-methyl-2-(1-methylpiperazin-2-yl)-N-(1H-pyrrol-2-ylmethyl)ethanamine
CID 115239646
(2S)-2-(2-fluoroethyl)-1-methylpiperazine
CID 124660399
N-methyl-N-[(1-methylpiperazin-2-yl)methyl]-2-(1-methylpyrrolidin-3-yl)ethanamine
CID 115238510
N,1-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]piperidin-3-amine
CID 115239598
1-(1-methylpiperazin-2-yl)propan-2-amine
CID 116941733
N,N-dimethyl-2-(4-methyl-1,4-diazepan-5-yl)ethanamine
CID 23090509
N-[2-(1,4-dimethylpiperazin-2-yl)ethyl]-N,2,5-trimethylhexan-1-amine
CID 142067796
N'-methyl-N'-[(1-methylpiperazin-2-yl)methyl]butane-1,4-diamine
CID 139528374
[(2R)-1-methylpiperazin-2-yl]methanol
CID 51669493
3-methyl-1-(1-methylpiperazin-2-yl)butan-2-amine
CID 116941732

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine?
The IUPAC name of N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine (CID 115239559) is N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine.
What is the SMILES notation for N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine?
The canonical SMILES for N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine is CC(C)CN(C)CCC1CNCCN1C.
What is the InChIKey of N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine?
The InChIKey is WUGGTWKESDVVFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3/c1-11(2)10-14(3)7-5-12-9-13-6-8-15(12)4/h11-13H,5-10H2,1-4H3.
What are the key properties of N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine?
N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine has a molecular weight of 213.37 g/mol, XLogP of 0.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[2-(1-methylpiperazin-2-yl)ethyl]propan-1-amine is sourced from PubChem (CID 115239559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).