N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine

C16H21N3O — CID 103096785

IUPACN-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine
SMILESCc1cnc(CNC2CCN(c3ccccc3)CC2)o1
InChIInChI=1S/C16H21N3O/c1-13-11-18-16(20-13)12-17-14-7-9-19(10-8-14)15-5-3-2-4-6-15/h2-6,11,14,17H,7-10,12H2,1H3
InChIKeyWFNZRJPVIKGJOQ-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.74
Rot. Bonds4

About N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine (PubChem CID 103096785) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine
PubChem CID103096785
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine
SMILESCc1cnc(CNC2CCN(c3ccccc3)CC2)o1
InChIInChI=1S/C16H21N3O/c1-13-11-18-16(20-13)12-17-14-7-9-19(10-8-14)15-5-3-2-4-6-15/h2-6,11,14,17H,7-10,12H2,1H3
InChIKeyWFNZRJPVIKGJOQ-UHFFFAOYSA-N
XLogP2.74
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 103275609
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-phenylpiperidin-4-amine
CID 103625271
N-[(5-methylpyrazin-2-yl)methyl]-1-phenylpiperidin-4-amine
CID 103778023
N-[(3-methyl-2-pyridinyl)methyl]-1-phenylpiperidin-4-amine
CID 103782068
5-methyl-2-[(4-phenylpiperazin-1-yl)methyl]-1,3-oxazole
CID 22762631
N-[(6-methyl-2-pyridinyl)methyl]-1-phenylpiperidin-4-amine
CID 103778062
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 103275527
4-ethyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]cyclohexan-1-amine
CID 103275539
1-phenyl-N-(1,3-thiazol-5-ylmethyl)piperidin-4-amine
CID 103792728
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-phenylpiperidin-4-amine
CID 103625283
N-[[5-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]methyl]-1-phenylpiperidin-4-amine
CID 47621541
N-[(2-methylcyclopropyl)methyl]-1-phenylpiperidin-4-amine
CID 103779083

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine?
The IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine (CID 103096785) is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine.
What is the SMILES notation for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine?
The canonical SMILES for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine is Cc1cnc(CNC2CCN(c3ccccc3)CC2)o1.
What is the InChIKey of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine?
The InChIKey is WFNZRJPVIKGJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-13-11-18-16(20-13)12-17-14-7-9-19(10-8-14)15-5-3-2-4-6-15/h2-6,11,14,17H,7-10,12H2,1H3.
What are the key properties of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine?
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine has a molecular weight of 271.36 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylpiperidin-4-amine is sourced from PubChem (CID 103096785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).