N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide

C13H15N3O2 — CID 4877074

IUPACN-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESO=C(NCC1CCCO1)c1n[nH]c2ccccc12
InChIInChI=1S/C13H15N3O2/c17-13(14-8-9-4-3-7-18-9)12-10-5-1-2-6-11(10)15-16-12/h1-2,5-6,9H,3-4,7-8H2,(H,14,17)(H,15,16)
InChIKeyWYPQXQSZNWGUDR-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.47
Rot. Bonds3

About N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide

N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide (PubChem CID 4877074) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide
PubChem CID4877074
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide
SMILESO=C(NCC1CCCO1)c1n[nH]c2ccccc12
InChIInChI=1S/C13H15N3O2/c17-13(14-8-9-4-3-7-18-9)12-10-5-1-2-6-11(10)15-16-12/h1-2,5-6,9H,3-4,7-8H2,(H,14,17)(H,15,16)
InChIKeyWYPQXQSZNWGUDR-UHFFFAOYSA-N
XLogP1.47
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxolan-2-ylmethyl)-1H-indazole-4-carboxamide
CID 47330976
N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]-1H-indazole-3-carboxamide
CID 30538306
3-methyl-N-(oxolan-2-ylmethyl)-1H-indole-2-carboxamide
CID 110849538
2-oxo-N-(oxolan-2-ylmethyl)-1H-quinoline-4-carboxamide
CID 2977759
2-(1H-indol-3-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 30385068
N-[[(2S)-oxolan-2-yl]methyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 50985207
N-[[(2S)-oxolan-2-yl]methyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 94913783
N-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 53017368
N-(oxolan-2-ylmethyl)-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxamide
CID 110388812
N-(oxolan-2-ylmethyl)-9H-pyrido[3,4-b]indole-3-carboxamide
CID 3383149
1H-indazol-3-yl-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]methanone
CID 9463048
N-[[(2S)-oxolan-2-yl]methyl]-N-[(3S)-thiolan-3-yl]-1H-indazole-3-carboxamide
CID 97083953

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide (CID 4877074) is N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide is O=C(NCC1CCCO1)c1n[nH]c2ccccc12.
What is the InChIKey of N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide?
The InChIKey is WYPQXQSZNWGUDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c17-13(14-8-9-4-3-7-18-9)12-10-5-1-2-6-11(10)15-16-12/h1-2,5-6,9H,3-4,7-8H2,(H,14,17)(H,15,16).
What are the key properties of N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide?
N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 4877074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).