N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine

C11H22N4 — CID 79504264

IUPACN-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
SMILESCN1CCN(C)C(CNC2=NCCC2)C1
InChIInChI=1S/C11H22N4/c1-14-6-7-15(2)10(9-14)8-13-11-4-3-5-12-11/h10H,3-9H2,1-2H3,(H,12,13)
InChIKeyRSZXKFOTVYIVPA-UHFFFAOYSA-N
MW210.32 g/mol
LogP0.01
Rot. Bonds2

About N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine

N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine (PubChem CID 79504264) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine.

Molecular Properties

Compound NameN-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
PubChem CID79504264
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC NameN-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine
SMILESCN1CCN(C)C(CNC2=NCCC2)C1
InChIInChI=1S/C11H22N4/c1-14-6-7-15(2)10(9-14)8-13-11-4-3-5-12-11/h10H,3-9H2,1-2H3,(H,12,13)
InChIKeyRSZXKFOTVYIVPA-UHFFFAOYSA-N
XLogP0.01
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
The IUPAC name of N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine (CID 79504264) is N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine.
What is the SMILES notation for N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
The canonical SMILES for N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine is CN1CCN(C)C(CNC2=NCCC2)C1.
What is the InChIKey of N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
The InChIKey is RSZXKFOTVYIVPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-14-6-7-15(2)10(9-14)8-13-11-4-3-5-12-11/h10H,3-9H2,1-2H3,(H,12,13).
What are the key properties of N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine?
N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine has a molecular weight of 210.32 g/mol, XLogP of 0.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpiperazin-2-yl)methyl]-3,4-dihydro-2H-pyrrol-5-amine is sourced from PubChem (CID 79504264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).