N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide

C15H21NO5 — CID 43516699

IUPACN-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide
SMILESCOc1cc(CO)cc(OC)c1OCC(=O)NCC1CC1
InChIInChI=1S/C15H21NO5/c1-19-12-5-11(8-17)6-13(20-2)15(12)21-9-14(18)16-7-10-3-4-10/h5-6,10,17H,3-4,7-9H2,1-2H3,(H,16,18)
InChIKeySBNRDAVUYZDIEK-UHFFFAOYSA-N
MW295.34 g/mol
LogP1.10
Rot. Bonds8

About N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide

N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide (PubChem CID 43516699) has the molecular formula C15H21NO5 and a molecular weight of 295.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide
PubChem CID43516699
Molecular FormulaC15H21NO5
Molecular Weight295.34 g/mol
Exact Mass295.14
IUPAC NameN-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide
SMILESCOc1cc(CO)cc(OC)c1OCC(=O)NCC1CC1
InChIInChI=1S/C15H21NO5/c1-19-12-5-11(8-17)6-13(20-2)15(12)21-9-14(18)16-7-10-3-4-10/h5-6,10,17H,3-4,7-9H2,1-2H3,(H,16,18)
InChIKeySBNRDAVUYZDIEK-UHFFFAOYSA-N
XLogP1.10
TPSA77.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-chloro-4-(hydroxymethyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide
CID 28898320
N-(cyclopropylmethyl)-2-[2-methoxy-5-(methylaminomethyl)phenoxy]acetamide
CID 43278722
2-[2-(cyclopropylmethylamino)-2-oxoethoxy]-3-methoxybenzoic acid
CID 43471767
2-[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]-N-prop-2-ynylacetamide
CID 43622673
N-(cyclohexylmethyl)-2-(2-methoxyphenoxy)acetamide
CID 2083257
[4-(cyclobutylmethoxy)-3,5-dimethoxyphenyl]methanol
CID 65458991
2-[4-(hydroxymethyl)-2-iodo-6-methoxyphenoxy]-N-pentylacetamide
CID 167759308
[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol
CID 15752535
2-(cyclopropylmethylamino)-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide
CID 119691576
2-[2-(2-aminopropyl)-6-methoxyphenoxy]-N-(cyclopropylmethyl)acetamide
CID 60907032
N-(cyclopropylmethyl)-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]acetamide
CID 79882213
2-(2-amino-5-methoxyphenoxy)-N-(cyclopropylmethyl)acetamide
CID 102702513

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide (CID 43516699) is N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide is COc1cc(CO)cc(OC)c1OCC(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide?
The InChIKey is SBNRDAVUYZDIEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO5/c1-19-12-5-11(8-17)6-13(20-2)15(12)21-9-14(18)16-7-10-3-4-10/h5-6,10,17H,3-4,7-9H2,1-2H3,(H,16,18).
What are the key properties of N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide?
N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide has a molecular weight of 295.34 g/mol, XLogP of 1.10, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]acetamide is sourced from PubChem (CID 43516699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).