2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine

C15H22N2O2 — CID 65184735

IUPAC2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine
SMILESCc1occc1-c1cnc(CCCNC(C)(C)C)o1
InChIInChI=1S/C15H22N2O2/c1-11-12(7-9-18-11)13-10-16-14(19-13)6-5-8-17-15(2,3)4/h7,9-10,17H,5-6,8H2,1-4H3
InChIKeyJNMQVOMVTNAVCU-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.56
Rot. Bonds5

About 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine

2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine (PubChem CID 65184735) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine
PubChem CID65184735
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine
SMILESCc1occc1-c1cnc(CCCNC(C)(C)C)o1
InChIInChI=1S/C15H22N2O2/c1-11-12(7-9-18-11)13-10-16-14(19-13)6-5-8-17-15(2,3)4/h7,9-10,17H,5-6,8H2,1-4H3
InChIKeyJNMQVOMVTNAVCU-UHFFFAOYSA-N
XLogP3.56
TPSA51.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]ethanamine
CID 65179075
N-[3-[5-(5-bromofuran-2-yl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-2-amine
CID 65185034
N-[3-[5-(4,5-dimethylthiophen-2-yl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-2-amine
CID 65238025
N-[2-[5-(5-bromo-2-methylphenyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine
CID 65309326
N-[2-[5-(2-bromo-3-methylphenyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine
CID 107984140
2-methyl-N-[2-[5-(2-methylsulfanylphenyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 79206242
2-[5-(2-chlorofuran-3-yl)-1,3-oxazol-2-yl]-N-methylethanamine
CID 106690347
N-[2-[5-(2-fluoro-4-methoxyphenyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine
CID 102885570
N-[3-[5-(cyclopropylmethyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-2-amine
CID 65184883
N-[2-[5-(2-bromo-5-methoxyphenyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine
CID 65182601
2-methyl-N-[2-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 65182553
2-methyl-N-[3-[5-(oxan-4-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine
CID 65184626

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine (CID 65184735) is 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine is Cc1occc1-c1cnc(CCCNC(C)(C)C)o1.
What is the InChIKey of 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
The InChIKey is JNMQVOMVTNAVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-12(7-9-18-11)13-10-16-14(19-13)6-5-8-17-15(2,3)4/h7,9-10,17H,5-6,8H2,1-4H3.
What are the key properties of 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine?
2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine has a molecular weight of 262.35 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-[5-(2-methylfuran-3-yl)-1,3-oxazol-2-yl]propyl]propan-2-amine is sourced from PubChem (CID 65184735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).