N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine

C12H23N5 — CID 63266461

IUPACN-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine
SMILESCN(CCN1CCNCC1)CCn1cccn1
InChIInChI=1S/C12H23N5/c1-15(10-12-17-6-2-3-14-17)9-11-16-7-4-13-5-8-16/h2-3,6,13H,4-5,7-12H2,1H3
InChIKeyMDTRKZVELSUTDQ-UHFFFAOYSA-N
MW237.35 g/mol
LogP-0.28
Rot. Bonds6

About N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine

N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine (PubChem CID 63266461) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine
PubChem CID63266461
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC NameN-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine
SMILESCN(CCN1CCNCC1)CCn1cccn1
InChIInChI=1S/C12H23N5/c1-15(10-12-17-6-2-3-14-17)9-11-16-7-4-13-5-8-16/h2-3,6,13H,4-5,7-12H2,1H3
InChIKeyMDTRKZVELSUTDQ-UHFFFAOYSA-N
XLogP-0.28
TPSA36.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[methyl(2-pyrazol-1-ylethyl)amino]-1-piperazin-1-ylpropan-1-one
CID 120982786
2-[methyl(2-pyrazol-1-ylethyl)amino]-1-piperazin-1-ylethanone
CID 54960870
N-methyl-N-(2-piperazin-1-ylethyl)nonan-1-amine
CID 63265554
N-methyl-N-(2-piperazin-1-ylethyl)-2-pyridin-4-ylethanamine
CID 54943962
N,N,N'-trimethyl-N'-(2-piperazin-1-ylethyl)propane-1,3-diamine
CID 63695224
N-[(1-ethylimidazol-2-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine
CID 63266168
N-methyl-2-piperazin-1-yl-N-(pyridin-2-ylmethyl)ethanamine
CID 54945083
N-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-N-methyl-2-piperazin-1-ylethanamine
CID 63265435
N,N'-dimethyl-N'-[2-[methyl(2-piperazin-1-ylethyl)amino]ethyl]ethane-1,2-diamine
CID 126510399
3-ethylsulfonyl-N-methyl-N-(2-piperazin-1-ylethyl)propan-1-amine
CID 65098202
N-propyl-N-(2-pyrazol-1-ylethyl)piperidin-4-amine
CID 54960820
N-methyl-N-(2-piperazin-1-ylethyl)prop-2-en-1-amine
CID 63265346

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine?
The IUPAC name of N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine (CID 63266461) is N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine.
What is the SMILES notation for N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine?
The canonical SMILES for N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine is CN(CCN1CCNCC1)CCn1cccn1.
What is the InChIKey of N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine?
The InChIKey is MDTRKZVELSUTDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-15(10-12-17-6-2-3-14-17)9-11-16-7-4-13-5-8-16/h2-3,6,13H,4-5,7-12H2,1H3.
What are the key properties of N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine?
N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine has a molecular weight of 237.35 g/mol, XLogP of -0.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine is sourced from PubChem (CID 63266461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).