N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine

C11H25N3 — CID 116910990

IUPACN,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine
SMILESCC(C)C(C1CN(C)CCN1)N(C)C
InChIInChI=1S/C11H25N3/c1-9(2)11(13(3)4)10-8-14(5)7-6-12-10/h9-12H,6-8H2,1-5H3
InChIKeyHXUZBMAUSKDXGK-UHFFFAOYSA-N
MW199.34 g/mol
LogP0.48
Rot. Bonds3

About N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine

N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine (PubChem CID 116910990) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine.

Molecular Properties

Compound NameN,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine
PubChem CID116910990
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC NameN,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine
SMILESCC(C)C(C1CN(C)CCN1)N(C)C
InChIInChI=1S/C11H25N3/c1-9(2)11(13(3)4)10-8-14(5)7-6-12-10/h9-12H,6-8H2,1-5H3
InChIKeyHXUZBMAUSKDXGK-UHFFFAOYSA-N
XLogP0.48
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methylpiperazin-2-yl)ethanamine
CID 116941341
N,N,2-trimethyl-1-pyrrolidin-2-ylpropan-1-amine
CID 116906314
N,N-dimethyl-1-(4-methylpiperazin-2-yl)-1-(1-methylpiperidin-3-yl)methanamine
CID 116911029
3-(4-methylpiperazin-2-yl)butan-2-one
CID 82412326
N,N-dimethyl-1-(4-methylpiperazin-2-yl)-1-pyridin-2-ylmethanamine
CID 116911018
(3R)-1-methyl-3-propan-2-yl-1,4-diazocane
CID 131122145
N,N-dimethyl-1-(4-methylpiperazin-2-yl)-1-(3-methylthiophen-2-yl)methanamine
CID 116911032
(3R)-1,3-dimethylpiperazine;ethane
CID 143846249
1,3-dimethylpiperazine;ethane
CID 167500512
N,N-dimethyl-1-(1-methylpiperidin-3-yl)-1-pyrrolidin-2-ylmethanamine
CID 116906350
(4-methylphenyl)-(4-methylpiperazin-2-yl)methanamine
CID 116941344
(3R)-1,3-dimethylpiperazine;molecular hydrogen
CID 145424168

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine?
The IUPAC name of N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine (CID 116910990) is N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine.
What is the SMILES notation for N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine?
The canonical SMILES for N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine is CC(C)C(C1CN(C)CCN1)N(C)C.
What is the InChIKey of N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine?
The InChIKey is HXUZBMAUSKDXGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3/c1-9(2)11(13(3)4)10-8-14(5)7-6-12-10/h9-12H,6-8H2,1-5H3.
What are the key properties of N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine?
N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 0.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-1-(4-methylpiperazin-2-yl)propan-1-amine is sourced from PubChem (CID 116910990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).