N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine

C10H14N4 — CID 163759001

IUPACN,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine
SMILESc1c[nH]c(NCCNc2ccc[nH]2)c1
InChIInChI=1S/C10H14N4/c1-3-9(11-5-1)13-7-8-14-10-4-2-6-12-10/h1-6,11-14H,7-8H2
InChIKeyLWNWGVHQBMFTBN-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.87
Rot. Bonds5

About N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine

N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine (PubChem CID 163759001) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine
PubChem CID163759001
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC NameN,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine
SMILESc1c[nH]c(NCCNc2ccc[nH]2)c1
InChIInChI=1S/C10H14N4/c1-3-9(11-5-1)13-7-8-14-10-4-2-6-12-10/h1-6,11-14H,7-8H2
InChIKeyLWNWGVHQBMFTBN-UHFFFAOYSA-N
XLogP1.87
TPSA55.64 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N'-(1H-pyrrol-2-yl)propane-1,3-diamine
CID 115197680
lithium;N-ethyl-1H-pyrrol-2-amine;hydride
CID 173205429
N-(1H-pyrrol-2-yl)-1H-pyrrol-2-amine
CID 68544991
N-[5-(1H-pyrrol-2-ylamino)pentyl]acetamide
CID 67602472
N-[2-(1H-indol-3-yl)ethyl]-1H-pyrrol-2-amine
CID 164562122
2-propan-2-yl-N'-(1H-pyrrol-2-yl)propane-1,3-diamine
CID 115252329
N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-pyrrol-2-amine
CID 115244513
N-iodosyl-1H-pyrrol-2-amine
CID 163738400
3-methyl-4-(1H-pyrrol-2-ylamino)butanoic acid
CID 115219718
2-hydroxy-N-(1H-pyrrol-2-yl)acetamide
CID 115139588
1-[(1H-pyrrol-2-ylamino)methyl]cyclobutane-1-carboxylic acid
CID 115246382
1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine
CID 163581197

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine?
The IUPAC name of N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine (CID 163759001) is N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine?
The canonical SMILES for N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine is c1c[nH]c(NCCNc2ccc[nH]2)c1.
What is the InChIKey of N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine?
The InChIKey is LWNWGVHQBMFTBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-3-9(11-5-1)13-7-8-14-10-4-2-6-12-10/h1-6,11-14H,7-8H2.
What are the key properties of N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine?
N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine has a molecular weight of 190.25 g/mol, XLogP of 1.87, 5 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 163759001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).