N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide

C16H17N3O2 — CID 78320742

IUPACN-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C16H17N3O2/c1-19(2)9-16(20)18-12-3-4-14-13-5-6-17-8-11(13)10-21-15(14)7-12/h3-8H,9-10H2,1-2H3,(H,18,20)
InChIKeyHUAFUIUKYGGEGD-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.14
Rot. Bonds3

About N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide

N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide (PubChem CID 78320742) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide.

Molecular Properties

Compound NameN-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide
PubChem CID78320742
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C16H17N3O2/c1-19(2)9-16(20)18-12-3-4-14-13-5-6-17-8-11(13)10-21-15(14)7-12/h3-8H,9-10H2,1-2H3,(H,18,20)
InChIKeyHUAFUIUKYGGEGD-UHFFFAOYSA-N
XLogP2.14
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide?
The IUPAC name of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide (CID 78320742) is N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide.
What is the SMILES notation for N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide?
The canonical SMILES for N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide is CN(C)CC(=O)Nc1ccc2c(c1)OCc1cnccc1-2.
What is the InChIKey of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide?
The InChIKey is HUAFUIUKYGGEGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-19(2)9-16(20)18-12-3-4-14-13-5-6-17-8-11(13)10-21-15(14)7-12/h3-8H,9-10H2,1-2H3,(H,18,20).
What are the key properties of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide?
N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide has a molecular weight of 283.33 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(dimethylamino)acetamide is sourced from PubChem (CID 78320742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).