(2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide

C14H17Cl2NO2 — CID 2706554

IUPAC(2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide
SMILESC[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)NC1CCCC1
InChIInChI=1S/C14H17Cl2NO2/c1-9(14(18)17-10-4-2-3-5-10)19-11-6-7-12(15)13(16)8-11/h6-10H,2-5H2,1H3,(H,17,18)/t9-/m1/s1
InChIKeyLQHTZAPAPHEERP-SECBINFHSA-N
MW302.20 g/mol
LogP3.82
Rot. Bonds4

About (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide

(2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide (PubChem CID 2706554) has the molecular formula C14H17Cl2NO2 and a molecular weight of 302.20 g/mol. Its IUPAC name is (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide
PubChem CID2706554
Molecular FormulaC14H17Cl2NO2
Molecular Weight302.20 g/mol
Exact Mass301.06
IUPAC Name(2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide
SMILESC[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)NC1CCCC1
InChIInChI=1S/C14H17Cl2NO2/c1-9(14(18)17-10-4-2-3-5-10)19-11-6-7-12(15)13(16)8-11/h6-10H,2-5H2,1H3,(H,17,18)/t9-/m1/s1
InChIKeyLQHTZAPAPHEERP-SECBINFHSA-N
XLogP3.82
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.20
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dichlorophenoxy)-N-piperidin-4-ylpropanamide
CID 119386601
2-chloro-5-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 106500745
(2R)-2-(3-chloro-4-fluorophenoxy)-N-cyclopropylpropanamide
CID 7751160
2-(3,4-dichlorophenoxy)-N-propan-2-ylpropanamide
CID 47109802
2-(3,4-dichlorophenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride
CID 120600845
(2S)-N-cyclopentyl-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100702405
N-cyclooctyl-2-(4-fluorophenoxy)propanamide
CID 42909316
(2R)-N-cycloheptyl-2-phenoxypropanamide
CID 669971
4-[1-(cyclohexylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 43084651
N-cyclododecyl-2-(3-methylphenoxy)propanamide
CID 3912808
(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
CID 7868566
2-(4-tert-butylphenoxy)-N-cycloheptylpropanamide
CID 19203440

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide?
The IUPAC name of (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide (CID 2706554) is (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide.
What is the SMILES notation for (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide?
The canonical SMILES for (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide is C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)NC1CCCC1.
What is the InChIKey of (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide?
The InChIKey is LQHTZAPAPHEERP-SECBINFHSA-N. The full InChI is InChI=1S/C14H17Cl2NO2/c1-9(14(18)17-10-4-2-3-5-10)19-11-6-7-12(15)13(16)8-11/h6-10H,2-5H2,1H3,(H,17,18)/t9-/m1/s1.
What are the key properties of (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide?
(2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide has a molecular weight of 302.20 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopentyl-2-(3,4-dichlorophenoxy)propanamide is sourced from PubChem (CID 2706554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).