ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide

C17H28N4O2 — CID 176558070

IUPACethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide
SMILESCC.CC.CCCN(C(=O)NC=O)c1cnc2c(C)cccn12
InChIInChI=1S/C13H16N4O2.2C2H6/c1-3-6-17(13(19)15-9-18)11-8-14-12-10(2)5-4-7-16(11)12;2*1-2/h4-5,7-9H,3,6H2,1-2H3,(H,15,18,19);2*1-2H3
InChIKeyJPFSFYPZHUTWKG-UHFFFAOYSA-N
MW320.44 g/mol
LogP3.78
Rot. Bonds4

About ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide

ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide (PubChem CID 176558070) has the molecular formula C17H28N4O2 and a molecular weight of 320.44 g/mol. Its IUPAC name is ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide.

Molecular Properties

Compound Nameethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide
PubChem CID176558070
Molecular FormulaC17H28N4O2
Molecular Weight320.44 g/mol
Exact Mass320.22
IUPAC Nameethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide
SMILESCC.CC.CCCN(C(=O)NC=O)c1cnc2c(C)cccn12
InChIInChI=1S/C13H16N4O2.2C2H6/c1-3-6-17(13(19)15-9-18)11-8-14-12-10(2)5-4-7-16(11)12;2*1-2/h4-5,7-9H,3,6H2,1-2H3,(H,15,18,19);2*1-2H3
InChIKeyJPFSFYPZHUTWKG-UHFFFAOYSA-N
XLogP3.78
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide?
The IUPAC name of ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide (CID 176558070) is ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide.
What is the SMILES notation for ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide?
The canonical SMILES for ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide is CC.CC.CCCN(C(=O)NC=O)c1cnc2c(C)cccn12.
What is the InChIKey of ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide?
The InChIKey is JPFSFYPZHUTWKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2.2C2H6/c1-3-6-17(13(19)15-9-18)11-8-14-12-10(2)5-4-7-16(11)12;2*1-2/h4-5,7-9H,3,6H2,1-2H3,(H,15,18,19);2*1-2H3.
What are the key properties of ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide?
ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide has a molecular weight of 320.44 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[(8-methylimidazo[1,2-a]pyridin-3-yl)-propylcarbamoyl]formamide is sourced from PubChem (CID 176558070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).