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

C15H26N2O — CID 107185156

IUPAC2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
SMILESCC(C)CNCCc1ncc(C2CCCC2C)o1
InChIInChI=1S/C15H26N2O/c1-11(2)9-16-8-7-15-17-10-14(18-15)13-6-4-5-12(13)3/h10-13,16H,4-9H2,1-3H3
InChIKeyYPFWZRGNXRNSAB-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.37
Rot. Bonds6

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

2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine (PubChem CID 107185156) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
PubChem CID107185156
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
SMILESCC(C)CNCCc1ncc(C2CCCC2C)o1
InChIInChI=1S/C15H26N2O/c1-11(2)9-16-8-7-15-17-10-14(18-15)13-6-4-5-12(13)3/h10-13,16H,4-9H2,1-3H3
InChIKeyYPFWZRGNXRNSAB-UHFFFAOYSA-N
XLogP3.37
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N-[3-[5-(5-methyloxolan-2-yl)-1,3-oxazol-2-yl]propyl]propan-1-amine
CID 81327217
N-[(5-cyclobutyl-1,3-oxazol-2-yl)methyl]-2-methylpropan-1-amine
CID 65181714
N-[[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 107185095
N-[2-[5-(cyclohexylmethyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-1-amine
CID 65182513
N-[3-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]propyl]-2-methylpropan-1-amine
CID 107185194
N-[(5-cyclooctyl-1,3-oxazol-2-yl)methyl]-2-methylpropan-1-amine
CID 65181968
2-methyl-N-[2-[5-(3-methylbutyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 65182651
N-ethyl-2-[5-(5-methyloxolan-2-yl)-1,3-oxazol-2-yl]ethanamine
CID 81327813
2-methyl-N-[3-(5-propan-2-yl-1,3-oxazol-2-yl)propyl]propan-1-amine
CID 65185038
N-[[5-(2,2-dimethylcyclopropyl)-1,3-oxazol-2-yl]methyl]-2-methylpropan-1-amine
CID 107003479
2-methyl-N-[2-[5-(4-propan-2-ylphenyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 65182659
3-(5-cyclobutyl-1,3-oxazol-2-yl)-N-(2-methoxyethyl)propan-1-amine
CID 65184648

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine (CID 107185156) is 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine is CC(C)CNCCc1ncc(C2CCCC2C)o1.
What is the InChIKey of 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?
The InChIKey is YPFWZRGNXRNSAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-11(2)9-16-8-7-15-17-10-14(18-15)13-6-4-5-12(13)3/h10-13,16H,4-9H2,1-3H3.
What are the key properties of 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine?
2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]ethyl]propan-1-amine is sourced from PubChem (CID 107185156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).