N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine

C11H20N4 — CID 115255619

IUPACN-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine
SMILESCC(CNc1cc[nH]c1)N1CCNCC1
InChIInChI=1S/C11H20N4/c1-10(15-6-4-12-5-7-15)8-14-11-2-3-13-9-11/h2-3,9-10,12-14H,4-8H2,1H3
InChIKeyLRKYHLXVOGETBD-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.72
Rot. Bonds4

About N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine

N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine (PubChem CID 115255619) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine.

Molecular Properties

Compound NameN-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine
PubChem CID115255619
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine
SMILESCC(CNc1cc[nH]c1)N1CCNCC1
InChIInChI=1S/C11H20N4/c1-10(15-6-4-12-5-7-15)8-14-11-2-3-13-9-11/h2-3,9-10,12-14H,4-8H2,1H3
InChIKeyLRKYHLXVOGETBD-UHFFFAOYSA-N
XLogP0.72
TPSA43.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine
CID 115230284
N-(2-piperazin-1-ylpropyl)thiophen-2-amine
CID 115255603
N-methyl-3-piperazin-1-yl-1-(1H-pyrrol-3-yl)butan-1-amine
CID 116960921
3-piperazin-1-yl-N-[2-(1H-pyrrol-3-yl)ethyl]butan-1-amine
CID 115255519
2,5-difluoro-N-(2-piperazin-1-ylpropyl)aniline
CID 115255614
N-methyl-2-piperazin-1-yl-N-[2-(1H-pyrrol-3-yl)ethyl]propan-1-amine
CID 115255786
1-[2-methyl-1-(1H-pyrrol-3-yl)propyl]piperazine
CID 82283605
2-methyl-N-(2-piperazin-1-ylpropyl)-2-(1H-pyrrol-2-yl)propan-1-amine
CID 115255800
N-methyl-2-piperazin-1-yl-1-(1H-pyrrol-3-yl)propan-1-amine
CID 116960983
N-[2-(azocan-1-yl)propyl]aniline
CID 62558695
N-[2-(4-methylphenyl)ethyl]-2-piperazin-1-ylpropan-1-amine
CID 115255755
N-[(1-methylpiperidin-4-yl)methyl]-2-piperazin-1-ylpropan-1-amine
CID 115255719

Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine?
The IUPAC name of N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine (CID 115255619) is N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine.
What is the SMILES notation for N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine?
The canonical SMILES for N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine is CC(CNc1cc[nH]c1)N1CCNCC1.
What is the InChIKey of N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine?
The InChIKey is LRKYHLXVOGETBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-10(15-6-4-12-5-7-15)8-14-11-2-3-13-9-11/h2-3,9-10,12-14H,4-8H2,1H3.
What are the key properties of N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine?
N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine has a molecular weight of 208.31 g/mol, XLogP of 0.72, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine is sourced from PubChem (CID 115255619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).