N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine

C16H18N4 — CID 18007557

IUPACN,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine
SMILESCN(C)CCn1ncc2ccc(-c3ccncc3)cc21
InChIInChI=1S/C16H18N4/c1-19(2)9-10-20-16-11-14(3-4-15(16)12-18-20)13-5-7-17-8-6-13/h3-8,11-12H,9-10H2,1-2H3
InChIKeyBVTJMLFECAYKDZ-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.66
Rot. Bonds4

About N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine

N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine (PubChem CID 18007557) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine
PubChem CID18007557
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC NameN,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine
SMILESCN(C)CCn1ncc2ccc(-c3ccncc3)cc21
InChIInChI=1S/C16H18N4/c1-19(2)9-10-20-16-11-14(3-4-15(16)12-18-20)13-5-7-17-8-6-13/h3-8,11-12H,9-10H2,1-2H3
InChIKeyBVTJMLFECAYKDZ-UHFFFAOYSA-N
XLogP2.66
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine (CID 18007557) is N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine is CN(C)CCn1ncc2ccc(-c3ccncc3)cc21.
What is the InChIKey of N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine?
The InChIKey is BVTJMLFECAYKDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-19(2)9-10-20-16-11-14(3-4-15(16)12-18-20)13-5-7-17-8-6-13/h3-8,11-12H,9-10H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine?
N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine has a molecular weight of 266.35 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(6-pyridin-4-ylindazol-1-yl)ethanamine is sourced from PubChem (CID 18007557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).