N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide

C15H24N2O3 — CID 115593507

IUPACN-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide
SMILESCOc1ccc(CN(C)C)cc1NC(=O)COC(C)C
InChIInChI=1S/C15H24N2O3/c1-11(2)20-10-15(18)16-13-8-12(9-17(3)4)6-7-14(13)19-5/h6-8,11H,9-10H2,1-5H3,(H,16,18)
InChIKeyUYFLCSCTXRHJQV-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.12
Rot. Bonds7

About N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide

N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide (PubChem CID 115593507) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide
PubChem CID115593507
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide
SMILESCOc1ccc(CN(C)C)cc1NC(=O)COC(C)C
InChIInChI=1S/C15H24N2O3/c1-11(2)20-10-15(18)16-13-8-12(9-17(3)4)6-7-14(13)19-5/h6-8,11H,9-10H2,1-5H3,(H,16,18)
InChIKeyUYFLCSCTXRHJQV-UHFFFAOYSA-N
XLogP2.12
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxy-5-methylphenyl)-2-propan-2-yloxyacetamide
CID 47410584
3-amino-N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]propanamide
CID 43703754
N-(5-chloro-2-methoxyphenyl)-2-propan-2-yloxyacetamide
CID 47412284
(2S,3S)-2-amino-N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-3-methylpentanamide
CID 61178895
5-[(dimethylamino)methyl]-2-methoxy-N-propan-2-ylaniline
CID 43686566
N-(5-chloro-2,4-dimethoxyphenyl)-2-propan-2-yloxyacetamide
CID 47410572
N-(5-ethyl-2-methoxyphenyl)propanamide
CID 110777230
N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-4-hydroxypyrrolidine-2-carboxamide
CID 43703764
5-[(dimethylamino)methyl]-N-(2,2-dimethylpropyl)-2-methoxyaniline
CID 61324530
(3S)-N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]piperidine-3-carboxamide
CID 81119695
2-[(3,4-dimethoxyphenyl)methyl-methylamino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 9058407
N-(2-chloro-5-methoxyphenyl)-2-propan-2-yloxyacetamide
CID 47423695

Frequently Asked Questions

What is the IUPAC name of N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide (CID 115593507) is N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide is COc1ccc(CN(C)C)cc1NC(=O)COC(C)C.
What is the InChIKey of N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide?
The InChIKey is UYFLCSCTXRHJQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11(2)20-10-15(18)16-13-8-12(9-17(3)4)6-7-14(13)19-5/h6-8,11H,9-10H2,1-5H3,(H,16,18).
What are the key properties of N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide?
N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide has a molecular weight of 280.37 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-2-propan-2-yloxyacetamide is sourced from PubChem (CID 115593507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).