N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide

C18H20N4O2 — CID 50948881

IUPACN-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESCCC(CO)N(Cc1ccccn1)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C18H20N4O2/c1-2-14(12-23)22(11-13-7-5-6-10-19-13)18(24)17-15-8-3-4-9-16(15)20-21-17/h3-10,14,23H,2,11-12H2,1H3,(H,20,21)
InChIKeyLOFQHAWUGQLODM-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.37
Rot. Bonds6

About N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide

N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide (PubChem CID 50948881) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide
PubChem CID50948881
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC NameN-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESCCC(CO)N(Cc1ccccn1)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C18H20N4O2/c1-2-14(12-23)22(11-13-7-5-6-10-19-13)18(24)17-15-8-3-4-9-16(15)20-21-17/h3-10,14,23H,2,11-12H2,1H3,(H,20,21)
InChIKeyLOFQHAWUGQLODM-UHFFFAOYSA-N
XLogP2.37
TPSA82.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-N-(2-pyridin-2-ylethyl)-1H-indazole-3-carboxamide
CID 52768641
N-methyl-N-pyridin-2-yl-1H-indazole-3-carboxamide
CID 64983096
2-chloro-N-[(2R)-1-hydroxybutan-2-yl]-5-pyrazol-1-yl-N-(pyridin-2-ylmethyl)benzamide
CID 95132846
N-(2-amino-2-oxoethyl)-N-propan-2-yl-1H-indazole-3-carboxamide
CID 60636572
N-methyl-N-(2-methylbutyl)-1H-indazole-3-carboxamide
CID 63932230
N'-[(2R)-1-hydroxybutan-2-yl]-N-(4-methylphenyl)-N'-(pyridin-2-ylmethyl)propanediamide
CID 95120471
N-(1-hydroxybutan-2-yl)-3-phenyl-N-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176507008
N-[(2R)-1-hydroxybutan-2-yl]-1H-indazole-3-carboxamide
CID 103920152
N-(3-ethylpentan-2-yl)-1H-indazole-3-carboxamide
CID 63851037
N-(2,2-difluoroethyl)-N-propyl-1H-indazole-3-carboxamide
CID 60608504
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-1H-indazole-3-carboxamide
CID 42594608
N-[(2-methylphenyl)methyl]-4-oxo-N-(pyridin-2-ylmethyl)-3H-phthalazine-1-carboxamide
CID 166194800

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide (CID 50948881) is N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide is CCC(CO)N(Cc1ccccn1)C(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide?
The InChIKey is LOFQHAWUGQLODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-2-14(12-23)22(11-13-7-5-6-10-19-13)18(24)17-15-8-3-4-9-16(15)20-21-17/h3-10,14,23H,2,11-12H2,1H3,(H,20,21).
What are the key properties of N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide?
N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxybutan-2-yl)-N-(pyridin-2-ylmethyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 50948881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).