1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine

C13H22N4 — CID 106565897

IUPAC1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine
SMILESCC(C)Nc1nccn1C1CCN(C2CC2)C1
InChIInChI=1S/C13H22N4/c1-10(2)15-13-14-6-8-17(13)12-5-7-16(9-12)11-3-4-11/h6,8,10-12H,3-5,7,9H2,1-2H3,(H,14,15)
InChIKeySIBDYJNTIPOAHJ-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.11
Rot. Bonds4

About 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine

1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine (PubChem CID 106565897) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound Name1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine
PubChem CID106565897
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine
SMILESCC(C)Nc1nccn1C1CCN(C2CC2)C1
InChIInChI=1S/C13H22N4/c1-10(2)15-13-14-6-8-17(13)12-5-7-16(9-12)11-3-4-11/h6,8,10-12H,3-5,7,9H2,1-2H3,(H,14,15)
InChIKeySIBDYJNTIPOAHJ-UHFFFAOYSA-N
XLogP2.11
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine?
The IUPAC name of 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine (CID 106565897) is 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine.
What is the SMILES notation for 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine?
The canonical SMILES for 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine is CC(C)Nc1nccn1C1CCN(C2CC2)C1.
What is the InChIKey of 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine?
The InChIKey is SIBDYJNTIPOAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-10(2)15-13-14-6-8-17(13)12-5-7-16(9-12)11-3-4-11/h6,8,10-12H,3-5,7,9H2,1-2H3,(H,14,15).
What are the key properties of 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine?
1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine has a molecular weight of 234.35 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylpyrrolidin-3-yl)-N-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 106565897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).