N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide

C16H18N2O3 — CID 75384527

IUPACN-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1ccon1)N(Cc1ccc(O)cc1)CC1CC1
InChIInChI=1S/C16H18N2O3/c19-15-5-3-13(4-6-15)11-18(10-12-1-2-12)16(20)9-14-7-8-21-17-14/h3-8,12,19H,1-2,9-11H2
InChIKeyROQFETWEPJNHQX-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.36
Rot. Bonds6

About N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide

N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide (PubChem CID 75384527) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide
PubChem CID75384527
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1ccon1)N(Cc1ccc(O)cc1)CC1CC1
InChIInChI=1S/C16H18N2O3/c19-15-5-3-13(4-6-15)11-18(10-12-1-2-12)16(20)9-14-7-8-21-17-14/h3-8,12,19H,1-2,9-11H2
InChIKeyROQFETWEPJNHQX-UHFFFAOYSA-N
XLogP2.36
TPSA66.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide (CID 75384527) is N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide is O=C(Cc1ccon1)N(Cc1ccc(O)cc1)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide?
The InChIKey is ROQFETWEPJNHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-15-5-3-13(4-6-15)11-18(10-12-1-2-12)16(20)9-14-7-8-21-17-14/h3-8,12,19H,1-2,9-11H2.
What are the key properties of N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide?
N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-[(4-hydroxyphenyl)methyl]-2-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 75384527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).