N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide

C16H26N2O2 — CID 120652211

IUPACN-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide
SMILESCCN[C@H](C)CNC(=O)CCCc1ccc(OC)cc1
InChIInChI=1S/C16H26N2O2/c1-4-17-13(2)12-18-16(19)7-5-6-14-8-10-15(20-3)11-9-14/h8-11,13,17H,4-7,12H2,1-3H3,(H,18,19)/t13-/m1/s1
InChIKeyOGGFLYFENCZFRC-CYBMUJFWSA-N
MW278.40 g/mol
LogP2.13
Rot. Bonds9

About N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide

N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide (PubChem CID 120652211) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide
PubChem CID120652211
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide
SMILESCCN[C@H](C)CNC(=O)CCCc1ccc(OC)cc1
InChIInChI=1S/C16H26N2O2/c1-4-17-13(2)12-18-16(19)7-5-6-14-8-10-15(20-3)11-9-14/h8-11,13,17H,4-7,12H2,1-3H3,(H,18,19)/t13-/m1/s1
InChIKeyOGGFLYFENCZFRC-CYBMUJFWSA-N
XLogP2.13
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-(ethylamino)propyl]-5-(4-methylphenyl)pentanamide
CID 120651415
3-(4-methoxyphenyl)-N-[(2S)-2-[3-(4-methoxyphenyl)propanoylamino]propyl]propanamide
CID 40592074
3-(2,5-dimethoxyphenyl)-N-[(2R)-2-(ethylamino)propyl]propanamide
CID 120650953
3-(ethylamino)-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 62838416
3-(4-tert-butylphenyl)-N-[(2R)-2-(ethylamino)propyl]propanamide
CID 120652975
N-hydroxy-4-(4-methoxyphenyl)butanamide
CID 53384800
4-(4-methoxyphenyl)-N-[2-(methylamino)ethyl]butanamide;hydrochloride
CID 119500056
5-(4-methoxyphenyl)-N-(3-methylbutyl)pentanamide
CID 110297852
4-(4-acetylphenoxy)-N-[(2R)-2-(ethylamino)propyl]butanamide
CID 120653275
N-[(2R)-2-(ethylamino)propyl]-4-phenoxybutanamide;hydrochloride
CID 120651118
N-[2-[2-[2-[2-[3-(butan-2-ylamino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]-4-(4-methoxyphenyl)butanamide
CID 171843476
4-(4-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]butanamide
CID 110297665

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide (CID 120652211) is N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide is CCN[C@H](C)CNC(=O)CCCc1ccc(OC)cc1.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide?
The InChIKey is OGGFLYFENCZFRC-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-17-13(2)12-18-16(19)7-5-6-14-8-10-15(20-3)11-9-14/h8-11,13,17H,4-7,12H2,1-3H3,(H,18,19)/t13-/m1/s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide?
N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide has a molecular weight of 278.40 g/mol, XLogP of 2.13, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-4-(4-methoxyphenyl)butanamide is sourced from PubChem (CID 120652211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).