N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide

C16H22N2O2 — CID 106486164

IUPACN-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide
SMILESCNCc1ccc(OCC(=O)N(C)C2=CCCC2)cc1
InChIInChI=1S/C16H22N2O2/c1-17-11-13-7-9-15(10-8-13)20-12-16(19)18(2)14-5-3-4-6-14/h5,7-10,17H,3-4,6,11-12H2,1-2H3
InChIKeyKHCMIENLOOHNQY-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.31
Rot. Bonds6

About N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide

N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide (PubChem CID 106486164) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide
PubChem CID106486164
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide
SMILESCNCc1ccc(OCC(=O)N(C)C2=CCCC2)cc1
InChIInChI=1S/C16H22N2O2/c1-17-11-13-7-9-15(10-8-13)20-12-16(19)18(2)14-5-3-4-6-14/h5,7-10,17H,3-4,6,11-12H2,1-2H3
InChIKeyKHCMIENLOOHNQY-UHFFFAOYSA-N
XLogP2.31
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylamino)phenoxy]acetamide
CID 54908869
2-[3-(aminomethyl)phenoxy]-N-(cyclopenten-1-yl)-N-methylacetamide
CID 106485021
4-[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethoxy]-2-methylbenzoic acid
CID 107671136
2-[3-[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethoxy]phenyl]acetic acid
CID 61398108
2-(4-aminophenoxy)-N-(cyclohexen-1-yl)-N-ethylacetamide
CID 61036345
2-bromo-N-(cyclopenten-1-yl)-N-methylacetamide
CID 81222619
N-(cyclohexen-1-yl)-N-methyl-2-phenylacetamide
CID 15816334
2-bromo-N-(cyclohexen-1-yl)-N-methylacetamide
CID 101200162
4-[2-[cyclohexen-1-yl(propyl)amino]-2-oxoethoxy]benzamide
CID 17436521
2-[4-(methylaminomethyl)phenoxy]-N-(propan-2-ylcarbamoyl)acetamide
CID 106486259
N-methyl-3-[4-(methylaminomethyl)phenoxy]propanamide
CID 62324162
2-[[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]-methylamino]acetic acid
CID 43442661

Frequently Asked Questions

What is the IUPAC name of N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide?
The IUPAC name of N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide (CID 106486164) is N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide.
What is the SMILES notation for N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide?
The canonical SMILES for N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide is CNCc1ccc(OCC(=O)N(C)C2=CCCC2)cc1.
What is the InChIKey of N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide?
The InChIKey is KHCMIENLOOHNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-17-11-13-7-9-15(10-8-13)20-12-16(19)18(2)14-5-3-4-6-14/h5,7-10,17H,3-4,6,11-12H2,1-2H3.
What are the key properties of N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide?
N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide has a molecular weight of 274.36 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopenten-1-yl)-N-methyl-2-[4-(methylaminomethyl)phenoxy]acetamide is sourced from PubChem (CID 106486164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).