N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide

C26H24N2O3 — CID 42939286

IUPACN-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide
SMILESO=C(NCC1CN(Cc2ccccc2)CCO1)c1ccc2c(c1)C(=O)c1ccccc1-2
InChIInChI=1S/C26H24N2O3/c29-25-23-9-5-4-8-21(23)22-11-10-19(14-24(22)25)26(30)27-15-20-17-28(12-13-31-20)16-18-6-2-1-3-7-18/h1-11,14,20H,12-13,15-17H2,(H,27,30)
InChIKeyVMILOTNZEGCJFS-UHFFFAOYSA-N
MW412.49 g/mol
LogP3.53
Rot. Bonds5

About N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide

N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide (PubChem CID 42939286) has the molecular formula C26H24N2O3 and a molecular weight of 412.49 g/mol. Its IUPAC name is N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide.

Molecular Properties

Compound NameN-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide
PubChem CID42939286
Molecular FormulaC26H24N2O3
Molecular Weight412.49 g/mol
Exact Mass412.18
IUPAC NameN-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide
SMILESO=C(NCC1CN(Cc2ccccc2)CCO1)c1ccc2c(c1)C(=O)c1ccccc1-2
InChIInChI=1S/C26H24N2O3/c29-25-23-9-5-4-8-21(23)22-11-10-19(14-24(22)25)26(30)27-15-20-17-28(12-13-31-20)16-18-6-2-1-3-7-18/h1-11,14,20H,12-13,15-17H2,(H,27,30)
InChIKeyVMILOTNZEGCJFS-UHFFFAOYSA-N
XLogP3.53
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-benzylmorpholin-2-yl)methyl]-4-fluorobenzamide
CID 46522835
N-[(4-benzylmorpholin-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 75460681
N-[(4-benzylmorpholin-2-yl)methyl]-2-chloroquinoline-6-carboxamide
CID 55731163
N-[(4-benzylmorpholin-2-yl)methyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 42886737
N-[(4-benzylmorpholin-2-yl)methyl]pyridine-4-carboxamide
CID 43019906
N-[(4-benzylmorpholin-2-yl)methyl]-3-(dimethylamino)benzamide
CID 78799093
(4-benzylmorpholin-2-yl)methylcarbamic acid
CID 21104645
N-[(4-benzylmorpholin-2-yl)methyl]-3,5-dimethoxybenzamide
CID 17480503
9,10-dioxo-N-[[(2S)-oxolan-2-yl]methyl]anthracene-2-carboxamide
CID 42559548
N-[(4-benzylmorpholin-2-yl)methyl]-3-(difluoromethoxy)-4-methoxybenzamide
CID 55740410
N-[(4-benzylmorpholin-2-yl)methyl]-3-nitro-4-pyrrolidin-1-ylbenzamide
CID 43006687
N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide
CID 8504076

Frequently Asked Questions

What is the IUPAC name of N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide?
The IUPAC name of N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide (CID 42939286) is N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide.
What is the SMILES notation for N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide?
The canonical SMILES for N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide is O=C(NCC1CN(Cc2ccccc2)CCO1)c1ccc2c(c1)C(=O)c1ccccc1-2.
What is the InChIKey of N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide?
The InChIKey is VMILOTNZEGCJFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O3/c29-25-23-9-5-4-8-21(23)22-11-10-19(14-24(22)25)26(30)27-15-20-17-28(12-13-31-20)16-18-6-2-1-3-7-18/h1-11,14,20H,12-13,15-17H2,(H,27,30).
What are the key properties of N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide?
N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide has a molecular weight of 412.49 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-benzylmorpholin-2-yl)methyl]-9-oxofluorene-2-carboxamide is sourced from PubChem (CID 42939286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).