(2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide

C21H28N2O2 — CID 99972258

IUPAC(2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide
SMILESC[C@@H](Oc1ccc2ccccc2c1)C(=O)NCCC1CCN(C)CC1
InChIInChI=1S/C21H28N2O2/c1-16(21(24)22-12-9-17-10-13-23(2)14-11-17)25-20-8-7-18-5-3-4-6-19(18)15-20/h3-8,15-17H,9-14H2,1-2H3,(H,22,24)/t16-/m1/s1
InChIKeyUNAMWIOPSSKJBE-MRXNPFEDSA-N
MW340.47 g/mol
LogP3.46
Rot. Bonds6

About (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide

(2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide (PubChem CID 99972258) has the molecular formula C21H28N2O2 and a molecular weight of 340.47 g/mol. Its IUPAC name is (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide.

Molecular Properties

Compound Name(2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide
PubChem CID99972258
Molecular FormulaC21H28N2O2
Molecular Weight340.47 g/mol
Exact Mass340.22
IUPAC Name(2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide
SMILESC[C@@H](Oc1ccc2ccccc2c1)C(=O)NCCC1CCN(C)CC1
InChIInChI=1S/C21H28N2O2/c1-16(21(24)22-12-9-17-10-13-23(2)14-11-17)25-20-8-7-18-5-3-4-6-19(18)15-20/h3-8,15-17H,9-14H2,1-2H3,(H,22,24)/t16-/m1/s1
InChIKeyUNAMWIOPSSKJBE-MRXNPFEDSA-N
XLogP3.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(4-tert-butylphenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 99702455
(2S)-2-(4-tert-butylphenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 99702454
(2S)-N-[3-(4-methylpiperazin-1-yl)propyl]-2-naphthalen-2-yloxypropanamide
CID 99972262
(2R)-2-(2-chlorophenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 99702543
(2R)-2-(4-methoxyphenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide
CID 99971602
(2S)-N-cyclopropyl-2-naphthalen-2-yloxypropanamide
CID 42561249
N'-(2-naphthalen-2-yloxypropanoyl)cyclopropanecarbohydrazide
CID 4940181
(2R)-2-(3-methylphenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide
CID 99818310
N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide
CID 45147924
(2S)-N-[4-(4-methylpiperazin-1-yl)phenyl]-2-naphthalen-2-yloxypropanamide
CID 99131039
2-naphthalen-2-yloxy-N-prop-2-enylpropanamide
CID 12873693
(2R)-N-methyl-2-naphthalen-2-yloxypropanamide
CID 42561231

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide?
The IUPAC name of (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide (CID 99972258) is (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide.
What is the SMILES notation for (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide?
The canonical SMILES for (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide is C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCCC1CCN(C)CC1.
What is the InChIKey of (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide?
The InChIKey is UNAMWIOPSSKJBE-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H28N2O2/c1-16(21(24)22-12-9-17-10-13-23(2)14-11-17)25-20-8-7-18-5-3-4-6-19(18)15-20/h3-8,15-17H,9-14H2,1-2H3,(H,22,24)/t16-/m1/s1.
What are the key properties of (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide?
(2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide has a molecular weight of 340.47 g/mol, XLogP of 3.46, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide is sourced from PubChem (CID 99972258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).