1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine

C12H19N3 — CID 59410271

IUPAC1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine
SMILESCC(C)c1ccc(N2CCC(N)C2)nc1
InChIInChI=1S/C12H19N3/c1-9(2)10-3-4-12(14-7-10)15-6-5-11(13)8-15/h3-4,7,9,11H,5-6,8,13H2,1-2H3
InChIKeyNMMQTNZXZPNTQT-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.74
Rot. Bonds2

About 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine

1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine (PubChem CID 59410271) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine
PubChem CID59410271
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine
SMILESCC(C)c1ccc(N2CCC(N)C2)nc1
InChIInChI=1S/C12H19N3/c1-9(2)10-3-4-12(14-7-10)15-6-5-11(13)8-15/h3-4,7,9,11H,5-6,8,13H2,1-2H3
InChIKeyNMMQTNZXZPNTQT-UHFFFAOYSA-N
XLogP1.74
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine?
The IUPAC name of 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine (CID 59410271) is 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine?
The canonical SMILES for 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine is CC(C)c1ccc(N2CCC(N)C2)nc1.
What is the InChIKey of 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine?
The InChIKey is NMMQTNZXZPNTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9(2)10-3-4-12(14-7-10)15-6-5-11(13)8-15/h3-4,7,9,11H,5-6,8,13H2,1-2H3.
What are the key properties of 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine?
1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine is sourced from PubChem (CID 59410271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).