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

C10H18N4 — CID 115230284

IUPACN-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine
SMILESc1cc(NCCN2CCNCC2)c[nH]1
InChIInChI=1S/C10H18N4/c1-2-12-9-10(1)13-5-8-14-6-3-11-4-7-14/h1-2,9,11-13H,3-8H2
InChIKeyLYKLJMSGZXNRQI-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.33
Rot. Bonds4

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

N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine (PubChem CID 115230284) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine.

Molecular Properties

Compound NameN-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine
PubChem CID115230284
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine
SMILESc1cc(NCCN2CCNCC2)c[nH]1
InChIInChI=1S/C10H18N4/c1-2-12-9-10(1)13-5-8-14-6-3-11-4-7-14/h1-2,9,11-13H,3-8H2
InChIKeyLYKLJMSGZXNRQI-UHFFFAOYSA-N
XLogP0.33
TPSA43.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-piperazin-1-ylethylamino)benzoic acid
CID 62230184
N-(2-piperazin-1-ylpropyl)-1H-pyrrol-3-amine
CID 115255619
2-methyl-N-(3-piperazin-1-ylpropyl)-2-(1H-pyrrol-3-yl)propan-1-amine
CID 115230643
N,N-dimethyl-4-(2-piperazin-1-ylethylamino)pyridine-2-carboxamide
CID 43600424
N-(1H-pyrrol-3-yl)piperazine-1-carboxamide
CID 82281793
3-piperazin-1-yl-N-(2-pyrrolidin-1-ylethyl)aniline;dihydrochloride
CID 67416459
N-(2-piperazin-1-ylethyl)-5-(trifluoromethyl)pyridin-2-amine
CID 43600453
2-methyl-N-(2-piperazin-1-ylethyl)-1,3-benzoxazol-5-amine
CID 115230302
2-methyl-N-(2-piperazin-1-ylethyl)-1,3-benzoxazol-6-amine
CID 115230297
5-fluoro-6-methyl-N-(2-piperazin-1-ylethyl)pyrimidin-4-amine
CID 114045681
3,5-difluoro-4-(2-piperazin-1-ylethylamino)benzoic acid
CID 63187540
4-methylsulfonyl-N-(3-piperazin-1-ylpropyl)aniline
CID 43453302

Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine?
The IUPAC name of N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine (CID 115230284) is N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine.
What is the SMILES notation for N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine?
The canonical SMILES for N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine is c1cc(NCCN2CCNCC2)c[nH]1.
What is the InChIKey of N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine?
The InChIKey is LYKLJMSGZXNRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-2-12-9-10(1)13-5-8-14-6-3-11-4-7-14/h1-2,9,11-13H,3-8H2.
What are the key properties of N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine?
N-(2-piperazin-1-ylethyl)-1H-pyrrol-3-amine has a molecular weight of 194.28 g/mol, XLogP of 0.33, 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-ylethyl)-1H-pyrrol-3-amine is sourced from PubChem (CID 115230284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).