N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide

C15H24N2O2 — CID 82314635

IUPACN-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(O)C(C)NC(C)(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-10(17-15(3,4)5)14(19)12-6-8-13(9-7-12)16-11(2)18/h6-10,14,17,19H,1-5H3,(H,16,18)
InChIKeyBTNIQLVAJSADBM-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.45
Rot. Bonds4

About N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide

N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide (PubChem CID 82314635) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide
PubChem CID82314635
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(O)C(C)NC(C)(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-10(17-15(3,4)5)14(19)12-6-8-13(9-7-12)16-11(2)18/h6-10,14,17,19H,1-5H3,(H,16,18)
InChIKeyBTNIQLVAJSADBM-UHFFFAOYSA-N
XLogP2.45
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]propanamide
CID 82315397
N-[4-(3-chloro-1,2-dihydroxypropyl)phenyl]acetamide
CID 171862528
3-[[1-(4-acetamidophenyl)-1-hydroxypropan-2-yl]amino]propanoic acid
CID 82314646
N-[4-[2-(tert-butylamino)propanoyl]phenyl]acetamide
CID 13458401
N-[4-[(1R)-1-amino-2,2-dimethylpropyl]phenyl]acetamide
CID 131465093
N-[4-[(1S)-1-amino-2,2-dimethylpropyl]phenyl]acetamide;hydrochloride
CID 171241846
(2S)-2-(4-acetamidoanilino)-N-tert-butylpropanamide
CID 35994885
2-[[1-(4-acetamidophenyl)-1-hydroxybutan-2-yl]amino]acetic acid
CID 82314656
N-[4-[2-[2-(4-acetamidophenyl)-2-hydroxyethyl]sulfonyl-1-hydroxyethyl]phenyl]acetamide
CID 86739754
N-[4-(2-bromo-1-hydroxyethyl)phenyl]acetamide
CID 22563212
4-(4-acetamidophenyl)-4-hydroxy-3-(methylamino)butanoic acid
CID 82348713
N-[4-[1-hydroxy-2-(propan-2-ylamino)propyl]phenyl]propanamide
CID 82315401

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide?
The IUPAC name of N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide (CID 82314635) is N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide?
The canonical SMILES for N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide is CC(=O)Nc1ccc(C(O)C(C)NC(C)(C)C)cc1.
What is the InChIKey of N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide?
The InChIKey is BTNIQLVAJSADBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10(17-15(3,4)5)14(19)12-6-8-13(9-7-12)16-11(2)18/h6-10,14,17,19H,1-5H3,(H,16,18).
What are the key properties of N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide?
N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.45, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(tert-butylamino)-1-hydroxypropyl]phenyl]acetamide is sourced from PubChem (CID 82314635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).