N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide

C14H20N2O2 — CID 91661447

IUPACN-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)Nc1ccccc1OCC1CC1
InChIInChI=1S/C14H20N2O2/c1-16(2)9-14(17)15-12-5-3-4-6-13(12)18-10-11-7-8-11/h3-6,11H,7-10H2,1-2H3,(H,15,17)
InChIKeyXBNKEYURLHSQRE-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.98
Rot. Bonds6

About N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide

N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide (PubChem CID 91661447) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide
PubChem CID91661447
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)Nc1ccccc1OCC1CC1
InChIInChI=1S/C14H20N2O2/c1-16(2)9-14(17)15-12-5-3-4-6-13(12)18-10-11-7-8-11/h3-6,11H,7-10H2,1-2H3,(H,15,17)
InChIKeyXBNKEYURLHSQRE-UHFFFAOYSA-N
XLogP1.98
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(cyclopropylmethoxy)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119799501
N-[2-(cyclopropylmethoxy)phenyl]-4-(methylamino)butanamide;hydrochloride
CID 119799491
2-[acetyl(cyclopropyl)amino]-N-(2-ethoxyphenyl)acetamide
CID 113158429
2-[2-[2-(cyclopropylmethoxy)anilino]-2-oxoethyl]-1,3-dihydroindene-2-carboxylic acid
CID 119137884
N-(2-ethoxyphenyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide
CID 63298223
1-[[2-(cyclopropylmethoxy)phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122085447
2-[cyclohexyl(methyl)amino]-N-[2-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54817408
N-[2-(cyclopropylmethoxy)phenyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111453726
N-[2-(cyclopropylmethoxy)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119332686
1-[2-[[4-(dimethylamino)cyclohexyl]methoxy]phenyl]-3-pyrazin-2-ylurea
CID 58842154
2-(diethylamino)-N-[2-(oxolan-2-ylmethoxy)phenyl]acetamide
CID 54813459
2-[cyclohexyl(methyl)amino]-N-[2-(2-ethoxyethoxy)phenyl]acetamide
CID 54817307

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide?
The IUPAC name of N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide (CID 91661447) is N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide?
The canonical SMILES for N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide is CN(C)CC(=O)Nc1ccccc1OCC1CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide?
The InChIKey is XBNKEYURLHSQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-16(2)9-14(17)15-12-5-3-4-6-13(12)18-10-11-7-8-11/h3-6,11H,7-10H2,1-2H3,(H,15,17).
What are the key properties of N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide?
N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide has a molecular weight of 248.33 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)phenyl]-2-(dimethylamino)acetamide is sourced from PubChem (CID 91661447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).