N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide

C19H21N5O — CID 118948087

IUPACN-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide
SMILESO=C(CC1CCNCC1)N(c1cccnc1)c1ccc2[nH]ncc2c1
InChIInChI=1S/C19H21N5O/c25-19(10-14-5-8-20-9-6-14)24(17-2-1-7-21-13-17)16-3-4-18-15(11-16)12-22-23-18/h1-4,7,11-14,20H,5-6,8-10H2,(H,22,23)
InChIKeyRSBZURGHUQVBCD-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.01
Rot. Bonds4

About N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide

N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide (PubChem CID 118948087) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide
PubChem CID118948087
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC NameN-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide
SMILESO=C(CC1CCNCC1)N(c1cccnc1)c1ccc2[nH]ncc2c1
InChIInChI=1S/C19H21N5O/c25-19(10-14-5-8-20-9-6-14)24(17-2-1-7-21-13-17)16-3-4-18-15(11-16)12-22-23-18/h1-4,7,11-14,20H,5-6,8-10H2,(H,22,23)
InChIKeyRSBZURGHUQVBCD-UHFFFAOYSA-N
XLogP3.01
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide?
The IUPAC name of N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide (CID 118948087) is N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide.
What is the SMILES notation for N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide?
The canonical SMILES for N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide is O=C(CC1CCNCC1)N(c1cccnc1)c1ccc2[nH]ncc2c1.
What is the InChIKey of N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide?
The InChIKey is RSBZURGHUQVBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c25-19(10-14-5-8-20-9-6-14)24(17-2-1-7-21-13-17)16-3-4-18-15(11-16)12-22-23-18/h1-4,7,11-14,20H,5-6,8-10H2,(H,22,23).
What are the key properties of N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide?
N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide has a molecular weight of 335.41 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-5-yl)-2-piperidin-4-yl-N-pyridin-3-ylacetamide is sourced from PubChem (CID 118948087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).