N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine

C14H20N6 — CID 103341850

IUPACN-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine
SMILESCCCNc1nc(-c2ccc[nH]2)nc(N2CCCC2)n1
InChIInChI=1S/C14H20N6/c1-2-7-16-13-17-12(11-6-5-8-15-11)18-14(19-13)20-9-3-4-10-20/h5-6,8,15H,2-4,7,9-10H2,1H3,(H,16,17,18,19)
InChIKeyOKRVMMOUFIATTG-UHFFFAOYSA-N
MW272.36 g/mol
LogP2.29
Rot. Bonds5

About N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine

N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine (PubChem CID 103341850) has the molecular formula C14H20N6 and a molecular weight of 272.36 g/mol. Its IUPAC name is N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine
PubChem CID103341850
Molecular FormulaC14H20N6
Molecular Weight272.36 g/mol
Exact Mass272.17
IUPAC NameN-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine
SMILESCCCNc1nc(-c2ccc[nH]2)nc(N2CCCC2)n1
InChIInChI=1S/C14H20N6/c1-2-7-16-13-17-12(11-6-5-8-15-11)18-14(19-13)20-9-3-4-10-20/h5-6,8,15H,2-4,7,9-10H2,1H3,(H,16,17,18,19)
InChIKeyOKRVMMOUFIATTG-UHFFFAOYSA-N
XLogP2.29
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine (CID 103341850) is N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine is CCCNc1nc(-c2ccc[nH]2)nc(N2CCCC2)n1.
What is the InChIKey of N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is OKRVMMOUFIATTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6/c1-2-7-16-13-17-12(11-6-5-8-15-11)18-14(19-13)20-9-3-4-10-20/h5-6,8,15H,2-4,7,9-10H2,1H3,(H,16,17,18,19).
What are the key properties of N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine?
N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 272.36 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-4-pyrrolidin-1-yl-6-(1H-pyrrol-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 103341850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).