2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide

C15H22ClNO3 — CID 43573477

IUPAC2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide
SMILESCC(C)N(CCO)C(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C15H22ClNO3/c1-11(2)17(9-10-18)14(19)15(3,4)20-13-7-5-12(16)6-8-13/h5-8,11,18H,9-10H2,1-4H3
InChIKeyOUDZNHARMBMAJO-UHFFFAOYSA-N
MW299.80 g/mol
LogP2.73
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide

2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide (PubChem CID 43573477) has the molecular formula C15H22ClNO3 and a molecular weight of 299.80 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide
PubChem CID43573477
Molecular FormulaC15H22ClNO3
Molecular Weight299.80 g/mol
Exact Mass299.13
IUPAC Name2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide
SMILESCC(C)N(CCO)C(=O)C(C)(C)Oc1ccc(Cl)cc1
InChIInChI=1S/C15H22ClNO3/c1-11(2)17(9-10-18)14(19)15(3,4)20-13-7-5-12(16)6-8-13/h5-8,11,18H,9-10H2,1-4H3
InChIKeyOUDZNHARMBMAJO-UHFFFAOYSA-N
XLogP2.73
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyethyl)-N-propan-2-yl-4-(trifluoromethoxy)benzamide
CID 43573749
2-[4-[(4-chlorophenyl)-difluoromethyl]phenoxy]-2-methylpropanoic acid;2-(dimethylamino)ethanol
CID 71494567
2-(4-chlorophenoxy)-N,N-bis(cyanomethyl)-2-methylpropanamide
CID 3645295
[3-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-hydroxypropyl] 2-(4-chlorophenoxy)-2-methylpropanoate
CID 22768000
CID 131878857
CID 131878857
2-(4-chlorophenoxy)-2-methylpropanoate
CID 6918953
2-[4-(4-chlorobenzoyl)phenoxy]-N-(2,3-dihydroxypropyl)-N-ethyl-2-methylpropanamide
CID 154991211
2-[4-[(4-chlorophenyl)-difluoromethyl]phenoxy]-2-methylpropanoic acid;2-(diethylamino)ethanol
CID 71494433
2-(4-chlorophenoxy)-N-[(4-chlorophenyl)methyl]-2-methylpropanamide
CID 2597715
2-(4-chlorophenoxy)-N-(cyclopentylmethyl)-N,2-dimethylpropanamide
CID 60603240
S-sulfanyl 2-(4-chlorophenoxy)-2-methylpropanethioate
CID 123279621
2-(4-chlorophenoxy)-N-[(2-fluorophenyl)methyl]-N,2-dimethylpropanamide
CID 52892039

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide (CID 43573477) is 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide is CC(C)N(CCO)C(=O)C(C)(C)Oc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide?
The InChIKey is OUDZNHARMBMAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO3/c1-11(2)17(9-10-18)14(19)15(3,4)20-13-7-5-12(16)6-8-13/h5-8,11,18H,9-10H2,1-4H3.
What are the key properties of 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide?
2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide has a molecular weight of 299.80 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-2-methyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 43573477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).