2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol

C20H24N4O — CID 134329906

IUPAC2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol
SMILESCCc1c(-c2ccnc(N)c2O)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C20H24N4O/c1-2-14-16-11-13(12-5-8-22-9-6-12)3-4-17(16)24-18(14)15-7-10-23-20(21)19(15)25/h3-4,7,10-12,22,24-25H,2,5-6,8-9H2,1H3,(H2,21,23)
InChIKeyKKGNFWXWOZESLY-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.55
Rot. Bonds3

About 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol

2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol (PubChem CID 134329906) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol.

Molecular Properties

Compound Name2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol
PubChem CID134329906
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol
SMILESCCc1c(-c2ccnc(N)c2O)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C20H24N4O/c1-2-14-16-11-13(12-5-8-22-9-6-12)3-4-17(16)24-18(14)15-7-10-23-20(21)19(15)25/h3-4,7,10-12,22,24-25H,2,5-6,8-9H2,1H3,(H2,21,23)
InChIKeyKKGNFWXWOZESLY-UHFFFAOYSA-N
XLogP3.55
TPSA86.96 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.55
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol?
The IUPAC name of 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol (CID 134329906) is 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol.
What is the SMILES notation for 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol?
The canonical SMILES for 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol is CCc1c(-c2ccnc(N)c2O)[nH]c2ccc(C3CCNCC3)cc12.
What is the InChIKey of 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol?
The InChIKey is KKGNFWXWOZESLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-2-14-16-11-13(12-5-8-22-9-6-12)3-4-17(16)24-18(14)15-7-10-23-20(21)19(15)25/h3-4,7,10-12,22,24-25H,2,5-6,8-9H2,1H3,(H2,21,23).
What are the key properties of 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol?
2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol has a molecular weight of 336.44 g/mol, XLogP of 3.55, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(3-ethyl-5-piperidin-4-yl-1H-indol-2-yl)pyridin-3-ol is sourced from PubChem (CID 134329906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).