N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine

C15H16N4 — CID 55075437

IUPACN-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine
SMILESCCNc1ncccc1Cn1ncc2ccccc21
InChIInChI=1S/C15H16N4/c1-2-16-15-13(7-5-9-17-15)11-19-14-8-4-3-6-12(14)10-18-19/h3-10H,2,11H2,1H3,(H,16,17)
InChIKeyMXYSCTGMFGTKRE-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.91
Rot. Bonds4

About N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine

N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine (PubChem CID 55075437) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine
PubChem CID55075437
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC NameN-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine
SMILESCCNc1ncccc1Cn1ncc2ccccc21
InChIInChI=1S/C15H16N4/c1-2-16-15-13(7-5-9-17-15)11-19-14-8-4-3-6-12(14)10-18-19/h3-10H,2,11H2,1H3,(H,16,17)
InChIKeyMXYSCTGMFGTKRE-UHFFFAOYSA-N
XLogP2.91
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine?
The IUPAC name of N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine (CID 55075437) is N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine.
What is the SMILES notation for N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine?
The canonical SMILES for N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine is CCNc1ncccc1Cn1ncc2ccccc21.
What is the InChIKey of N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine?
The InChIKey is MXYSCTGMFGTKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-2-16-15-13(7-5-9-17-15)11-19-14-8-4-3-6-12(14)10-18-19/h3-10H,2,11H2,1H3,(H,16,17).
What are the key properties of N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine?
N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine has a molecular weight of 252.32 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(indazol-1-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 55075437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).