N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine

C16H21N3O2 — CID 71973092

IUPACN-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
SMILESCOc1ccccc1NC1CCN(Cc2ccon2)CC1
InChIInChI=1S/C16H21N3O2/c1-20-16-5-3-2-4-15(16)17-13-6-9-19(10-7-13)12-14-8-11-21-18-14/h2-5,8,11,13,17H,6-7,9-10,12H2,1H3
InChIKeyRWZFWBZXNLWFMG-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.76
Rot. Bonds5

About N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine

N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine (PubChem CID 71973092) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
PubChem CID71973092
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
SMILESCOc1ccccc1NC1CCN(Cc2ccon2)CC1
InChIInChI=1S/C16H21N3O2/c1-20-16-5-3-2-4-15(16)17-13-6-9-19(10-7-13)12-14-8-11-21-18-14/h2-5,8,11,13,17H,6-7,9-10,12H2,1H3
InChIKeyRWZFWBZXNLWFMG-UHFFFAOYSA-N
XLogP2.76
TPSA50.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(2-chlorophenyl)methyl]-N-(2-methoxyphenyl)piperidin-4-amine
CID 3362451
methyl 2-[4-(2-methoxyanilino)piperidin-1-yl]acetate
CID 71857529
N-(2-methoxyphenyl)-1-propan-2-ylpiperidin-4-amine
CID 5131485
2-chloro-1-[4-(2-methoxyanilino)piperidin-1-yl]ethanone
CID 154803745
2-[4-(2-methoxyanilino)piperidin-1-yl]-N-pyridin-2-ylacetamide
CID 10735928
N-(2-methoxyphenyl)-1-methylsulfonylpiperidin-4-amine
CID 4270050
1-(1-benzylpiperidin-4-yl)-3-(2-methoxyphenyl)urea
CID 6469046
N-(2-methoxyphenyl)piperidin-4-amine;hydrochloride
CID 90237422
4-(2-methoxyanilino)cyclohexan-1-one
CID 117027862
1-[(2,5-dimethoxyphenyl)methyl]-N-(2-fluorophenyl)piperidin-4-amine
CID 7357181
N-(2-methoxyphenyl)oxolan-3-amine
CID 14978001
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 37177459

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The IUPAC name of N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine (CID 71973092) is N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine is COc1ccccc1NC1CCN(Cc2ccon2)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
The InChIKey is RWZFWBZXNLWFMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-20-16-5-3-2-4-15(16)17-13-6-9-19(10-7-13)12-14-8-11-21-18-14/h2-5,8,11,13,17H,6-7,9-10,12H2,1H3.
What are the key properties of N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine?
N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine has a molecular weight of 287.36 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 71973092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).