N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine

C10H21N3 — CID 159231487

IUPACN,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine
SMILESC=C(CN(C)C)N1CCN(C)CC1
InChIInChI=1S/C10H21N3/c1-10(9-11(2)3)13-7-5-12(4)6-8-13/h1,5-9H2,2-4H3
InChIKeyUKSPRYJLLJSWTD-UHFFFAOYSA-N
MW183.30 g/mol
LogP0.31
Rot. Bonds3

About N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine

N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine (PubChem CID 159231487) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine
PubChem CID159231487
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine
SMILESC=C(CN(C)C)N1CCN(C)CC1
InChIInChI=1S/C10H21N3/c1-10(9-11(2)3)13-7-5-12(4)6-8-13/h1,5-9H2,2-4H3
InChIKeyUKSPRYJLLJSWTD-UHFFFAOYSA-N
XLogP0.31
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine?
The IUPAC name of N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine (CID 159231487) is N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine.
What is the SMILES notation for N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine?
The canonical SMILES for N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine is C=C(CN(C)C)N1CCN(C)CC1.
What is the InChIKey of N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine?
The InChIKey is UKSPRYJLLJSWTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-10(9-11(2)3)13-7-5-12(4)6-8-13/h1,5-9H2,2-4H3.
What are the key properties of N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine?
N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine has a molecular weight of 183.30 g/mol, XLogP of 0.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-methylpiperazin-1-yl)prop-2-en-1-amine is sourced from PubChem (CID 159231487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).