5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine

C15H21N5 — CID 114719365

IUPAC5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine
SMILESCC(CN1CCCC1)n1cncc1-c1ccc(N)nc1
InChIInChI=1S/C15H21N5/c1-12(10-19-6-2-3-7-19)20-11-17-9-14(20)13-4-5-15(16)18-8-13/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H2,16,18)
InChIKeyTVEWZZTXXZCHDM-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.18
Rot. Bonds4

About 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine

5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine (PubChem CID 114719365) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine
PubChem CID114719365
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine
SMILESCC(CN1CCCC1)n1cncc1-c1ccc(N)nc1
InChIInChI=1S/C15H21N5/c1-12(10-19-6-2-3-7-19)20-11-17-9-14(20)13-4-5-15(16)18-8-13/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H2,16,18)
InChIKeyTVEWZZTXXZCHDM-UHFFFAOYSA-N
XLogP2.18
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine (CID 114719365) is 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine is CC(CN1CCCC1)n1cncc1-c1ccc(N)nc1.
What is the InChIKey of 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine?
The InChIKey is TVEWZZTXXZCHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-12(10-19-6-2-3-7-19)20-11-17-9-14(20)13-4-5-15(16)18-8-13/h4-5,8-9,11-12H,2-3,6-7,10H2,1H3,(H2,16,18).
What are the key properties of 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine?
5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine has a molecular weight of 271.37 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 114719365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).