N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide

C15H24N2O2 — CID 112514061

IUPACN-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide
SMILESCOc1ccc(C(CCN)C(C)C)cc1NC(C)=O
InChIInChI=1S/C15H24N2O2/c1-10(2)13(7-8-16)12-5-6-15(19-4)14(9-12)17-11(3)18/h5-6,9-10,13H,7-8,16H2,1-4H3,(H,17,18)
InChIKeyRRKLKVRNGTVCOS-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.74
Rot. Bonds6

About N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide

N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide (PubChem CID 112514061) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide
PubChem CID112514061
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide
SMILESCOc1ccc(C(CCN)C(C)C)cc1NC(C)=O
InChIInChI=1S/C15H24N2O2/c1-10(2)13(7-8-16)12-5-6-15(19-4)14(9-12)17-11(3)18/h5-6,9-10,13H,7-8,16H2,1-4H3,(H,17,18)
InChIKeyRRKLKVRNGTVCOS-UHFFFAOYSA-N
XLogP2.74
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[2-[2-(3-acetamido-4-methoxyphenyl)-2-hydroxyethyl]sulfonyl-1-hydroxyethyl]-2-methoxyphenyl]acetamide
CID 154379633
N-[2-methoxy-5-[1-methoxy-2-(methylamino)ethyl]phenyl]acetamide
CID 112514053
N-[2-(3,4-dimethoxyphenyl)-3-methylbutyl]acetamide
CID 110314862
2-acetamido-N-(2-methoxy-5-propan-2-ylphenyl)acetamide
CID 71156213
N-(5-iodo-2-methoxyphenyl)acetamide
CID 11737859
N-[5-(3-aminopentyl)-2-methoxyphenyl]acetamide
CID 112513422
4-amino-N-(2-methoxy-5-propan-2-ylphenyl)-3-methylbutanamide
CID 115156209
2-hydroxy-N-(2-methoxy-5-propan-2-ylphenyl)acetamide
CID 115139566
N-(3-acetamido-4-methoxyphenyl)-2-amino-3-methylbutanamide
CID 119278958
(3R)-3-(4-methoxyphenyl)-4-methylpentan-1-amine
CID 899124
N-(5-acetamido-2-methoxyphenyl)-3-amino-2-methylpropanamide
CID 62671021
N-(3-acetamido-4-methoxyphenyl)-2-amino-3-methylbutanamide;hydrochloride
CID 119278957

Frequently Asked Questions

What is the IUPAC name of N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide?
The IUPAC name of N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide (CID 112514061) is N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide.
What is the SMILES notation for N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide?
The canonical SMILES for N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide is COc1ccc(C(CCN)C(C)C)cc1NC(C)=O.
What is the InChIKey of N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide?
The InChIKey is RRKLKVRNGTVCOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10(2)13(7-8-16)12-5-6-15(19-4)14(9-12)17-11(3)18/h5-6,9-10,13H,7-8,16H2,1-4H3,(H,17,18).
What are the key properties of N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide?
N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-amino-4-methylpentan-3-yl)-2-methoxyphenyl]acetamide is sourced from PubChem (CID 112514061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).