2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide

C20H23N3O2 — CID 71129534

IUPAC2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide
SMILESCC(C)(C(N)=O)[C@@H]1c2ccccc2Oc2nc(N3CCCC3)ccc21
InChIInChI=1S/C20H23N3O2/c1-20(2,19(21)24)17-13-7-3-4-8-15(13)25-18-14(17)9-10-16(22-18)23-11-5-6-12-23/h3-4,7-10,17H,5-6,11-12H2,1-2H3,(H2,21,24)/t17-/m1/s1
InChIKeyHCIJJLYKARBWJR-QGZVFWFLSA-N
MW337.42 g/mol
LogP3.43
Rot. Bonds3

About 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide

2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide (PubChem CID 71129534) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide.

Molecular Properties

Compound Name2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide
PubChem CID71129534
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide
SMILESCC(C)(C(N)=O)[C@@H]1c2ccccc2Oc2nc(N3CCCC3)ccc21
InChIInChI=1S/C20H23N3O2/c1-20(2,19(21)24)17-13-7-3-4-8-15(13)25-18-14(17)9-10-16(22-18)23-11-5-6-12-23/h3-4,7-10,17H,5-6,11-12H2,1-2H3,(H2,21,24)/t17-/m1/s1
InChIKeyHCIJJLYKARBWJR-QGZVFWFLSA-N
XLogP3.43
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide?
The IUPAC name of 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide (CID 71129534) is 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide.
What is the SMILES notation for 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide?
The canonical SMILES for 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide is CC(C)(C(N)=O)[C@@H]1c2ccccc2Oc2nc(N3CCCC3)ccc21.
What is the InChIKey of 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide?
The InChIKey is HCIJJLYKARBWJR-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-20(2,19(21)24)17-13-7-3-4-8-15(13)25-18-14(17)9-10-16(22-18)23-11-5-6-12-23/h3-4,7-10,17H,5-6,11-12H2,1-2H3,(H2,21,24)/t17-/m1/s1.
What are the key properties of 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide?
2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide has a molecular weight of 337.42 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(5R)-2-pyrrolidin-1-yl-5H-chromeno[2,3-b]pyridin-5-yl]propanamide is sourced from PubChem (CID 71129534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).