1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine

C17H26N4 — CID 63786248

IUPAC1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine
SMILESCCC(N)Cc1c(N2CCCC(C)C2)nc2ccccn12
InChIInChI=1S/C17H26N4/c1-3-14(18)11-15-17(20-9-6-7-13(2)12-20)19-16-8-4-5-10-21(15)16/h4-5,8,10,13-14H,3,6-7,9,11-12,18H2,1-2H3
InChIKeyBPWUVNNLNYAROB-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.85
Rot. Bonds4

About 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine

1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine (PubChem CID 63786248) has the molecular formula C17H26N4 and a molecular weight of 286.42 g/mol. Its IUPAC name is 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine.

Molecular Properties

Compound Name1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine
PubChem CID63786248
Molecular FormulaC17H26N4
Molecular Weight286.42 g/mol
Exact Mass286.22
IUPAC Name1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine
SMILESCCC(N)Cc1c(N2CCCC(C)C2)nc2ccccn12
InChIInChI=1S/C17H26N4/c1-3-14(18)11-15-17(20-9-6-7-13(2)12-20)19-16-8-4-5-10-21(15)16/h4-5,8,10,13-14H,3,6-7,9,11-12,18H2,1-2H3
InChIKeyBPWUVNNLNYAROB-UHFFFAOYSA-N
XLogP2.85
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine?
The IUPAC name of 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine (CID 63786248) is 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine.
What is the SMILES notation for 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine?
The canonical SMILES for 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine is CCC(N)Cc1c(N2CCCC(C)C2)nc2ccccn12.
What is the InChIKey of 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine?
The InChIKey is BPWUVNNLNYAROB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4/c1-3-14(18)11-15-17(20-9-6-7-13(2)12-20)19-16-8-4-5-10-21(15)16/h4-5,8,10,13-14H,3,6-7,9,11-12,18H2,1-2H3.
What are the key properties of 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine?
1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine has a molecular weight of 286.42 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]butan-2-amine is sourced from PubChem (CID 63786248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).