4-ethyl-3-pyrrol-1-ylpyridin-2-amine

C11H13N3 — CID 89444919

IUPAC4-ethyl-3-pyrrol-1-ylpyridin-2-amine
SMILESCCc1ccnc(N)c1-n1cccc1
InChIInChI=1S/C11H13N3/c1-2-9-5-6-13-11(12)10(9)14-7-3-4-8-14/h3-8H,2H2,1H3,(H2,12,13)
InChIKeyGHSMDMLBTPYTFT-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.02
Rot. Bonds2

About 4-ethyl-3-pyrrol-1-ylpyridin-2-amine

4-ethyl-3-pyrrol-1-ylpyridin-2-amine (PubChem CID 89444919) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 4-ethyl-3-pyrrol-1-ylpyridin-2-amine.

Molecular Properties

Compound Name4-ethyl-3-pyrrol-1-ylpyridin-2-amine
PubChem CID89444919
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name4-ethyl-3-pyrrol-1-ylpyridin-2-amine
SMILESCCc1ccnc(N)c1-n1cccc1
InChIInChI=1S/C11H13N3/c1-2-9-5-6-13-11(12)10(9)14-7-3-4-8-14/h3-8H,2H2,1H3,(H2,12,13)
InChIKeyGHSMDMLBTPYTFT-UHFFFAOYSA-N
XLogP2.02
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-pyrazol-1-ylethyl)pyrimidin-4-amine
CID 131141065
ethane;3-propylpyridin-2-amine
CID 176926436
(3-ethyl-2-imidazol-1-ylphenyl)methanamine
CID 84670177
3-(2-ethylsulfonylethyl)pyridin-2-amine
CID 106731715
3-[(2-ethylimidazol-1-yl)methyl]pyridin-2-amine
CID 62465807
1-[(2-amino-3-pyridinyl)methyl]-3-ethylimidazol-2-one
CID 80583349
1-ethyl-3-methylimidazo[1,5-a]pyrazin-8-amine
CID 166808466
2-N-(2-pyrazol-1-ylethyl)pyrimidine-2,4-diamine
CID 115978219
4,5-diethylquinoline
CID 154662761
1-[(2-amino-3-pyridinyl)methyl]pyrimidin-2-one
CID 62464183
3-N-(2-ethylphenyl)pyrazine-2,3-diamine
CID 102985203
1-[(2-ethylphenyl)methyl]-1,2,4-triazol-3-amine
CID 165481060

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-pyrrol-1-ylpyridin-2-amine?
The IUPAC name of 4-ethyl-3-pyrrol-1-ylpyridin-2-amine (CID 89444919) is 4-ethyl-3-pyrrol-1-ylpyridin-2-amine.
What is the SMILES notation for 4-ethyl-3-pyrrol-1-ylpyridin-2-amine?
The canonical SMILES for 4-ethyl-3-pyrrol-1-ylpyridin-2-amine is CCc1ccnc(N)c1-n1cccc1.
What is the InChIKey of 4-ethyl-3-pyrrol-1-ylpyridin-2-amine?
The InChIKey is GHSMDMLBTPYTFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-9-5-6-13-11(12)10(9)14-7-3-4-8-14/h3-8H,2H2,1H3,(H2,12,13).
What are the key properties of 4-ethyl-3-pyrrol-1-ylpyridin-2-amine?
4-ethyl-3-pyrrol-1-ylpyridin-2-amine has a molecular weight of 187.25 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-pyrrol-1-ylpyridin-2-amine is sourced from PubChem (CID 89444919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).