2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide

C21H33N3O4 — CID 120914253

IUPAC2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide
SMILESCOc1cc(CNC2CCCC2C2COCCN2)ccc1OCC(=O)N(C)C
InChIInChI=1S/C21H33N3O4/c1-24(2)21(25)14-28-19-8-7-15(11-20(19)26-3)12-23-17-6-4-5-16(17)18-13-27-10-9-22-18/h7-8,11,16-18,22-23H,4-6,9-10,12-14H2,1-3H3
InChIKeyACACXOOMGBXTSO-UHFFFAOYSA-N
MW391.51 g/mol
LogP1.41
Rot. Bonds8

About 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide

2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide (PubChem CID 120914253) has the molecular formula C21H33N3O4 and a molecular weight of 391.51 g/mol. Its IUPAC name is 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide
PubChem CID120914253
Molecular FormulaC21H33N3O4
Molecular Weight391.51 g/mol
Exact Mass391.25
IUPAC Name2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide
SMILESCOc1cc(CNC2CCCC2C2COCCN2)ccc1OCC(=O)N(C)C
InChIInChI=1S/C21H33N3O4/c1-24(2)21(25)14-28-19-8-7-15(11-20(19)26-3)12-23-17-6-4-5-16(17)18-13-27-10-9-22-18/h7-8,11,16-18,22-23H,4-6,9-10,12-14H2,1-3H3
InChIKeyACACXOOMGBXTSO-UHFFFAOYSA-N
XLogP1.41
TPSA72.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.51
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide with MolForge

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Related Compounds

N-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120915043
N-[[4-(2-methoxyphenoxy)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120915889
N-[[3-(methoxymethyl)phenyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120915585
N-[(5-bromo-2-methoxyphenyl)methyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120916214
N-[(4-fluoro-3-methylphenyl)methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120914901
[3-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenyl]methanol
CID 120914335
N-[2-(3,4-dimethoxyphenyl)-2-methylpropyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120915500
N-[3-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenyl]cyclobutanecarboxamide
CID 120914967
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]-2-morpholin-3-ylcyclopentan-1-amine
CID 120913977
N-[2-(2-methoxy-5-methylphenyl)ethyl]-2-morpholin-3-ylcyclopentan-1-amine;hydrochloride
CID 120914820
2-[2-methoxy-4-[[(2-methylcyclopentyl)amino]methyl]phenoxy]-1-morpholin-4-ylethanone
CID 119123900
N'-[(4-fluorophenyl)methyl]-N'-methyl-N-(2-morpholin-3-ylcyclopentyl)ethane-1,2-diamine
CID 120915133

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide?
The IUPAC name of 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide (CID 120914253) is 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide?
The canonical SMILES for 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide is COc1cc(CNC2CCCC2C2COCCN2)ccc1OCC(=O)N(C)C.
What is the InChIKey of 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide?
The InChIKey is ACACXOOMGBXTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O4/c1-24(2)21(25)14-28-19-8-7-15(11-20(19)26-3)12-23-17-6-4-5-16(17)18-13-27-10-9-22-18/h7-8,11,16-18,22-23H,4-6,9-10,12-14H2,1-3H3.
What are the key properties of 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide?
2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide has a molecular weight of 391.51 g/mol, XLogP of 1.41, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-4-[[(2-morpholin-3-ylcyclopentyl)amino]methyl]phenoxy]-N,N-dimethylacetamide is sourced from PubChem (CID 120914253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).