4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide

C14H22N2O2 — CID 119337613

IUPAC4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide
SMILESCC(CC(O)c1ccccc1)NC(=O)CCCN
InChIInChI=1S/C14H22N2O2/c1-11(16-14(18)8-5-9-15)10-13(17)12-6-3-2-4-7-12/h2-4,6-7,11,13,17H,5,8-10,15H2,1H3,(H,16,18)
InChIKeyLNMKAGHRBMAKQS-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.35
Rot. Bonds7

About 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide

4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide (PubChem CID 119337613) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide.

Molecular Properties

Compound Name4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide
PubChem CID119337613
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide
SMILESCC(CC(O)c1ccccc1)NC(=O)CCCN
InChIInChI=1S/C14H22N2O2/c1-11(16-14(18)8-5-9-15)10-13(17)12-6-3-2-4-7-12/h2-4,6-7,11,13,17H,5,8-10,15H2,1H3,(H,16,18)
InChIKeyLNMKAGHRBMAKQS-UHFFFAOYSA-N
XLogP1.35
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(1-phenylpropan-2-yl)butanamide;hydrochloride
CID 138397977
N-cyclopentyl-N'-(4-hydroxy-4-phenylbutan-2-yl)butanediamide
CID 109478424
4-amino-N-(1-phenylpropyl)butanamide
CID 62305395
4-[(4-hydroxy-4-phenylbutan-2-yl)carbamoylamino]butanoic acid
CID 122022223
N-[(2S,4R)-4-hydroxy-4-phenylbutan-2-yl]-3-(5-methylfuran-2-yl)propanamide
CID 97071411
methyl 2-(4-aminobutanoylamino)-2-phenylacetate;hydrochloride
CID 119280894
3-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-methylbutanamide;hydrochloride
CID 120501802
7-amino-N-(3-methyl-1-phenylbutyl)heptanamide;hydrochloride
CID 119689313
3-amino-N-(1-phenylethyl)propanamide
CID 16784228
4-amino-N-[1-(4-phenylphenyl)ethyl]butanamide;hydrochloride
CID 119269129
N-(4-hydroxy-4-phenylbutan-2-yl)-2-(2-methoxyphenyl)acetamide
CID 71919972
5-oxo-5-(1-phenylpropan-2-ylamino)pentanoic acid
CID 54852739

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide?
The IUPAC name of 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide (CID 119337613) is 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide.
What is the SMILES notation for 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide?
The canonical SMILES for 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide is CC(CC(O)c1ccccc1)NC(=O)CCCN.
What is the InChIKey of 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide?
The InChIKey is LNMKAGHRBMAKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11(16-14(18)8-5-9-15)10-13(17)12-6-3-2-4-7-12/h2-4,6-7,11,13,17H,5,8-10,15H2,1H3,(H,16,18).
What are the key properties of 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide?
4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide has a molecular weight of 250.34 g/mol, XLogP of 1.35, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-hydroxy-4-phenylbutan-2-yl)butanamide is sourced from PubChem (CID 119337613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).