4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide

C12H18N2O2 — CID 123987680

IUPAC4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide
SMILESCC(CC(N)Cc1ccc(O)cc1)C(N)=O
InChIInChI=1S/C12H18N2O2/c1-8(12(14)16)6-10(13)7-9-2-4-11(15)5-3-9/h2-5,8,10,15H,6-7,13H2,1H3,(H2,14,16)
InChIKeyYIEZUKIQRBLJNB-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.77
Rot. Bonds5

About 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide

4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide (PubChem CID 123987680) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide.

Molecular Properties

Compound Name4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide
PubChem CID123987680
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide
SMILESCC(CC(N)Cc1ccc(O)cc1)C(N)=O
InChIInChI=1S/C12H18N2O2/c1-8(12(14)16)6-10(13)7-9-2-4-11(15)5-3-9/h2-5,8,10,15H,6-7,13H2,1H3,(H2,14,16)
InChIKeyYIEZUKIQRBLJNB-UHFFFAOYSA-N
XLogP0.77
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-amino-4-methylpentyl)phenol
CID 62754924
(2R)-2-amino-3-(4-hydroxyphenyl)propanamide
CID 10511575
2-amino-3-(4-hydroxyphenyl)propanamide;hydrobromide
CID 174991066
4-[(2R)-2-amino-3-hydroxypropyl]phenol;ethane
CID 143560226
2-hydrazinyl-3-(4-hydroxyphenyl)propanamide
CID 144742434
(2R)-2-amino-1-(4-hydroxyphenyl)-4-methylpentan-3-one
CID 139478348
4-[(2S)-2-aminopropyl]phenol;methanol
CID 142971966
4-[(2S)-2-aminopropyl]phenol;hydrochloride
CID 90673532
4-(2-aminopropyl)phenol;dihydrobromide
CID 23615767
azane;3-(4-hydroxyphenyl)-2-(methylamino)propanamide;3-(4-hydroxyphenyl)-2-(methylamino)propanoic acid
CID 158661642
(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propanamide
CID 70366423
bis(2-amino-3-(4-hydroxyphenyl)propanamide);2-amino-3-(4-hydroxyphenyl)propanoic acid
CID 67902185

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide?
The IUPAC name of 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide (CID 123987680) is 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide.
What is the SMILES notation for 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide?
The canonical SMILES for 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide is CC(CC(N)Cc1ccc(O)cc1)C(N)=O.
What is the InChIKey of 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide?
The InChIKey is YIEZUKIQRBLJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-8(12(14)16)6-10(13)7-9-2-4-11(15)5-3-9/h2-5,8,10,15H,6-7,13H2,1H3,(H2,14,16).
What are the key properties of 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide?
4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide has a molecular weight of 222.29 g/mol, XLogP of 0.77, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(4-hydroxyphenyl)-2-methylpentanamide is sourced from PubChem (CID 123987680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).