1-(4-methylpiperazin-1-yl)propan-2-amine

C8H19N3 — CID 16643482

IUPAC1-(4-methylpiperazin-1-yl)propan-2-amine
SMILESCC(N)CN1CCN(C)CC1
InChIInChI=1S/C8H19N3/c1-8(9)7-11-5-3-10(2)4-6-11/h8H,3-7,9H2,1-2H3
InChIKeyMWCFQIQMAIQSCI-UHFFFAOYSA-N
MW157.26 g/mol
LogP-0.42
Rot. Bonds2

About 1-(4-methylpiperazin-1-yl)propan-2-amine

1-(4-methylpiperazin-1-yl)propan-2-amine (PubChem CID 16643482) has the molecular formula C8H19N3 and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-(4-methylpiperazin-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4-methylpiperazin-1-yl)propan-2-amine
PubChem CID16643482
Molecular FormulaC8H19N3
Molecular Weight157.26 g/mol
Exact Mass157.16
IUPAC Name1-(4-methylpiperazin-1-yl)propan-2-amine
SMILESCC(N)CN1CCN(C)CC1
InChIInChI=1S/C8H19N3/c1-8(9)7-11-5-3-10(2)4-6-11/h8H,3-7,9H2,1-2H3
InChIKeyMWCFQIQMAIQSCI-UHFFFAOYSA-N
XLogP-0.42
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 5-0.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperazin-1-yl)propan-2-amine?
The IUPAC name of 1-(4-methylpiperazin-1-yl)propan-2-amine (CID 16643482) is 1-(4-methylpiperazin-1-yl)propan-2-amine.
What is the SMILES notation for 1-(4-methylpiperazin-1-yl)propan-2-amine?
The canonical SMILES for 1-(4-methylpiperazin-1-yl)propan-2-amine is CC(N)CN1CCN(C)CC1.
What is the InChIKey of 1-(4-methylpiperazin-1-yl)propan-2-amine?
The InChIKey is MWCFQIQMAIQSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3/c1-8(9)7-11-5-3-10(2)4-6-11/h8H,3-7,9H2,1-2H3.
What are the key properties of 1-(4-methylpiperazin-1-yl)propan-2-amine?
1-(4-methylpiperazin-1-yl)propan-2-amine has a molecular weight of 157.26 g/mol, XLogP of -0.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperazin-1-yl)propan-2-amine is sourced from PubChem (CID 16643482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).