N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide

C19H18FN3O3 — CID 166290871

IUPACN-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide
SMILESCc1ccc(F)c2[nH]c(C(=O)N3CCC3CNC(=O)c3ccoc3)cc12
InChIInChI=1S/C19H18FN3O3/c1-11-2-3-15(20)17-14(11)8-16(22-17)19(25)23-6-4-13(23)9-21-18(24)12-5-7-26-10-12/h2-3,5,7-8,10,13,22H,4,6,9H2,1H3,(H,21,24)
InChIKeyYKXMEICBXXDHKT-UHFFFAOYSA-N
MW355.37 g/mol
LogP2.85
Rot. Bonds4

About N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide

N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide (PubChem CID 166290871) has the molecular formula C19H18FN3O3 and a molecular weight of 355.37 g/mol. Its IUPAC name is N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide
PubChem CID166290871
Molecular FormulaC19H18FN3O3
Molecular Weight355.37 g/mol
Exact Mass355.13
IUPAC NameN-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide
SMILESCc1ccc(F)c2[nH]c(C(=O)N3CCC3CNC(=O)c3ccoc3)cc12
InChIInChI=1S/C19H18FN3O3/c1-11-2-3-15(20)17-14(11)8-16(22-17)19(25)23-6-4-13(23)9-21-18(24)12-5-7-26-10-12/h2-3,5,7-8,10,13,22H,4,6,9H2,1H3,(H,21,24)
InChIKeyYKXMEICBXXDHKT-UHFFFAOYSA-N
XLogP2.85
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.37
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(2S)-1-butanoylpyrrolidin-2-yl]methyl]-3-fluoro-4-methylbenzamide
CID 167976334
N-[[(2S)-8-(furan-3-carbonyl)-1-oxa-8-azaspiro[4.5]decan-2-yl]methyl]-3,4-dimethylbenzamide
CID 42237886
N-[2-[2-[(3-fluoro-4-methylbenzoyl)amino]ethylcarbamoylamino]ethyl]furan-3-carboxamide
CID 47071758
7-fluoro-4-methyl-N-[(2-prop-2-enoyl-6-oxa-2-azaspiro[3.4]octan-7-yl)methyl]-1H-indole-2-carboxamide
CID 166424614
N-[1-(furan-3-carbonyl)piperidin-4-yl]-4,6-dimethyl-1H-indole-2-carboxamide
CID 38199392
N-[[1-(6-fluoro-2-methylquinoline-4-carbonyl)piperidin-4-yl]methyl]furan-3-carboxamide
CID 131938558
N-[[1-(6-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-3-(tetrazol-1-yl)propanamide
CID 166371779
4-bromo-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzamide
CID 90521806
N-[[1-(4-methyl-3-oxo-1,4-benzoxazine-6-carbonyl)piperidin-4-yl]methyl]furan-3-carboxamide
CID 131908186
4-[(furan-3-carbonylamino)methyl]-N,N-dimethylpiperidine-1-carboxamide
CID 119103267
N-[[1-(6-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]-1,3-thiazole-5-carboxamide
CID 166290868
N-(cyclopentylmethyl)-4-fluoro-3-methylbenzamide
CID 55163457

Frequently Asked Questions

What is the IUPAC name of N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide?
The IUPAC name of N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide (CID 166290871) is N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide.
What is the SMILES notation for N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide?
The canonical SMILES for N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide is Cc1ccc(F)c2[nH]c(C(=O)N3CCC3CNC(=O)c3ccoc3)cc12.
What is the InChIKey of N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide?
The InChIKey is YKXMEICBXXDHKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O3/c1-11-2-3-15(20)17-14(11)8-16(22-17)19(25)23-6-4-13(23)9-21-18(24)12-5-7-26-10-12/h2-3,5,7-8,10,13,22H,4,6,9H2,1H3,(H,21,24).
What are the key properties of N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide?
N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide has a molecular weight of 355.37 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(7-fluoro-4-methyl-1H-indole-2-carbonyl)azetidin-2-yl]methyl]furan-3-carboxamide is sourced from PubChem (CID 166290871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).