1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine

C10H23N3 — CID 79659665

IUPAC1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine
SMILESCC(C)C(N)C1CN(C)CCN1C
InChIInChI=1S/C10H23N3/c1-8(2)10(11)9-7-12(3)5-6-13(9)4/h8-10H,5-7,11H2,1-4H3
InChIKeyOENXKQNTNFYBHM-UHFFFAOYSA-N
MW185.31 g/mol
LogP0.22
Rot. Bonds2

About 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine

1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine (PubChem CID 79659665) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine
PubChem CID79659665
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine
SMILESCC(C)C(N)C1CN(C)CCN1C
InChIInChI=1S/C10H23N3/c1-8(2)10(11)9-7-12(3)5-6-13(9)4/h8-10H,5-7,11H2,1-4H3
InChIKeyOENXKQNTNFYBHM-UHFFFAOYSA-N
XLogP0.22
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine?
The IUPAC name of 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine (CID 79659665) is 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine?
The canonical SMILES for 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine is CC(C)C(N)C1CN(C)CCN1C.
What is the InChIKey of 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine?
The InChIKey is OENXKQNTNFYBHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3/c1-8(2)10(11)9-7-12(3)5-6-13(9)4/h8-10H,5-7,11H2,1-4H3.
What are the key properties of 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine?
1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 79659665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).