2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine

C13H18N2 — CID 145149544

IUPAC2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine
SMILESCCCn1c(CC)cc2c(C)ccnc21
InChIInChI=1S/C13H18N2/c1-4-8-15-11(5-2)9-12-10(3)6-7-14-13(12)15/h6-7,9H,4-5,8H2,1-3H3
InChIKeyVDSSGICXLBVPET-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.32
Rot. Bonds3

About 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine

2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine (PubChem CID 145149544) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine
PubChem CID145149544
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine
SMILESCCCn1c(CC)cc2c(C)ccnc21
InChIInChI=1S/C13H18N2/c1-4-8-15-11(5-2)9-12-10(3)6-7-14-13(12)15/h6-7,9H,4-5,8H2,1-3H3
InChIKeyVDSSGICXLBVPET-UHFFFAOYSA-N
XLogP3.32
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-methyl-3-pentyl-1H-imidazo[4,5-b]pyridine-2-thione
CID 79288273
ethane;1-ethyl-4-methylpyrazolo[3,4-b]pyridine
CID 162761081
5-methyl-1-pent-2-enyl-1,8-naphthyridin-2-one
CID 139602622
3-(2-methylphenyl)-1-propyl-1,8-naphthyridin-2-one
CID 139602502
3-(2-fluoroethyl)-7-methyl-1H-imidazo[4,5-b]pyridine-2-thione
CID 130504394
4-phenyl-1-propyl-1,8-naphthyridin-2-one
CID 18969191
2-ethyl-3-propylimidazo[4,5-b]pyridine
CID 20777190
1,4-dimethyl-2-(1-methylpyrazol-4-yl)pyrrolo[2,3-b]pyridine
CID 171635530
1-methyl-2-pentylpyrrolo[2,3-b]pyridin-4-amine
CID 175491909
1-butyl-2-methyl-1,8-naphthyridin-4-one
CID 150875994
3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
CID 136750908
3-(2,2-dimethylpropyl)-7-methyl-1H-imidazo[4,5-b]pyridine-2-thione
CID 79288212

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine?
The IUPAC name of 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine (CID 145149544) is 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine.
What is the SMILES notation for 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine?
The canonical SMILES for 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine is CCCn1c(CC)cc2c(C)ccnc21.
What is the InChIKey of 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine?
The InChIKey is VDSSGICXLBVPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-4-8-15-11(5-2)9-12-10(3)6-7-14-13(12)15/h6-7,9H,4-5,8H2,1-3H3.
What are the key properties of 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine?
2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine has a molecular weight of 202.30 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methyl-1-propylpyrrolo[2,3-b]pyridine is sourced from PubChem (CID 145149544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).