N-pyrrolidin-3-yl-1H-pyrrol-2-amine

C8H13N3 — CID 115118615

IUPACN-pyrrolidin-3-yl-1H-pyrrol-2-amine
SMILESc1c[nH]c(NC2CCNC2)c1
InChIInChI=1S/C8H13N3/c1-2-8(10-4-1)11-7-3-5-9-6-7/h1-2,4,7,9-11H,3,5-6H2
InChIKeyUCDLFFMYMQULRC-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.79
Rot. Bonds2

About N-pyrrolidin-3-yl-1H-pyrrol-2-amine

N-pyrrolidin-3-yl-1H-pyrrol-2-amine (PubChem CID 115118615) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is N-pyrrolidin-3-yl-1H-pyrrol-2-amine.

Molecular Properties

Compound NameN-pyrrolidin-3-yl-1H-pyrrol-2-amine
PubChem CID115118615
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC NameN-pyrrolidin-3-yl-1H-pyrrol-2-amine
SMILESc1c[nH]c(NC2CCNC2)c1
InChIInChI=1S/C8H13N3/c1-2-8(10-4-1)11-7-3-5-9-6-7/h1-2,4,7,9-11H,3,5-6H2
InChIKeyUCDLFFMYMQULRC-UHFFFAOYSA-N
XLogP0.79
TPSA39.85 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-Aminopyrrole
CID 5324781
2-Pyrrol-1-yl-1H-imidazole
CID 22223704
2-Dimethylaminopyrrole
CID 15826366
N-Methyl-1H-pyrrol-2-amine
CID 17805735
2,4-Diaminopyrrole
CID 19935251
Aziridinylazole
CID 20447273
Diaminoazole
CID 20540606
Pyrrolylpyrrole
CID 21863152
Piperazinopyrrole
CID 22181888
2-(Piperidin-1-yl)-pyrrole
CID 22742155
Azolyl isocyanate
CID 23062270
1H-pyrrol-2-ylcyanamide
CID 57061971

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-yl-1H-pyrrol-2-amine?
The IUPAC name of N-pyrrolidin-3-yl-1H-pyrrol-2-amine (CID 115118615) is N-pyrrolidin-3-yl-1H-pyrrol-2-amine.
What is the SMILES notation for N-pyrrolidin-3-yl-1H-pyrrol-2-amine?
The canonical SMILES for N-pyrrolidin-3-yl-1H-pyrrol-2-amine is c1c[nH]c(NC2CCNC2)c1.
What is the InChIKey of N-pyrrolidin-3-yl-1H-pyrrol-2-amine?
The InChIKey is UCDLFFMYMQULRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-2-8(10-4-1)11-7-3-5-9-6-7/h1-2,4,7,9-11H,3,5-6H2.
What are the key properties of N-pyrrolidin-3-yl-1H-pyrrol-2-amine?
N-pyrrolidin-3-yl-1H-pyrrol-2-amine has a molecular weight of 151.21 g/mol, XLogP of 0.79, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-yl-1H-pyrrol-2-amine is sourced from PubChem (CID 115118615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).