N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide

C20H21FN4O2 — CID 60593064

IUPACN-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide
SMILESO=C(NCC(c1cccc(F)c1)N1CCOCC1)c1n[nH]c2ccccc12
InChIInChI=1S/C20H21FN4O2/c21-15-5-3-4-14(12-15)18(25-8-10-27-11-9-25)13-22-20(26)19-16-6-1-2-7-17(16)23-24-19/h1-7,12,18H,8-11,13H2,(H,22,26)(H,23,24)
InChIKeyZYGJXDRCAGJTQW-UHFFFAOYSA-N
MW368.41 g/mol
LogP2.51
Rot. Bonds5

About N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide

N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide (PubChem CID 60593064) has the molecular formula C20H21FN4O2 and a molecular weight of 368.41 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide
PubChem CID60593064
Molecular FormulaC20H21FN4O2
Molecular Weight368.41 g/mol
Exact Mass368.16
IUPAC NameN-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide
SMILESO=C(NCC(c1cccc(F)c1)N1CCOCC1)c1n[nH]c2ccccc12
InChIInChI=1S/C20H21FN4O2/c21-15-5-3-4-14(12-15)18(25-8-10-27-11-9-25)13-22-20(26)19-16-6-1-2-7-17(16)23-24-19/h1-7,12,18H,8-11,13H2,(H,22,26)(H,23,24)
InChIKeyZYGJXDRCAGJTQW-UHFFFAOYSA-N
XLogP2.51
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.41
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-1H-indazole-3-carboxamide
CID 99970306
N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide
CID 47081662
N-[(2R)-2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]-1H-indazole-3-carboxamide
CID 52798650
N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 47081658
N-[2-(2-chlorophenyl)-2-pyrrolidin-1-ylethyl]-1H-indazole-3-carboxamide
CID 24638668
N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-4-carboxamide
CID 42886342
1-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-3-(2-phenylethyl)urea
CID 60592399
1-[(2R)-2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-3-(2-methylprop-2-enyl)urea
CID 99702436
1-amino-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119865951
1-(cyclopentylmethyl)-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-5-methyltriazole-4-carboxamide
CID 139005900
N-[2-(3-fluorophenyl)ethyl]-1H-indazole-3-carboxamide
CID 17397516
7-amino-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]heptanamide;dihydrochloride
CID 119865953

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide (CID 60593064) is N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide is O=C(NCC(c1cccc(F)c1)N1CCOCC1)c1n[nH]c2ccccc12.
What is the InChIKey of N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide?
The InChIKey is ZYGJXDRCAGJTQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN4O2/c21-15-5-3-4-14(12-15)18(25-8-10-27-11-9-25)13-22-20(26)19-16-6-1-2-7-17(16)23-24-19/h1-7,12,18H,8-11,13H2,(H,22,26)(H,23,24).
What are the key properties of N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide?
N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide has a molecular weight of 368.41 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 60593064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).