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

C15H24N2O — CID 97309834

IUPACN-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine
SMILESCc1noc(C2CC2)c1N[C@@H](C)CC1CCCC1
InChIInChI=1S/C15H24N2O/c1-10(9-12-5-3-4-6-12)16-14-11(2)17-18-15(14)13-7-8-13/h10,12-13,16H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyDCHSDZVCDLYYPL-JTQLQIEISA-N
MW248.37 g/mol
LogP4.24
Rot. Bonds5

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

N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine (PubChem CID 97309834) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine.

Molecular Properties

Compound NameN-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine
PubChem CID97309834
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine
SMILESCc1noc(C2CC2)c1N[C@@H](C)CC1CCCC1
InChIInChI=1S/C15H24N2O/c1-10(9-12-5-3-4-6-12)16-14-11(2)17-18-15(14)13-7-8-13/h10,12-13,16H,3-9H2,1-2H3/t10-/m0/s1
InChIKeyDCHSDZVCDLYYPL-JTQLQIEISA-N
XLogP4.24
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine?
The IUPAC name of N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine (CID 97309834) is N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine.
What is the SMILES notation for N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine?
The canonical SMILES for N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine is Cc1noc(C2CC2)c1N[C@@H](C)CC1CCCC1.
What is the InChIKey of N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine?
The InChIKey is DCHSDZVCDLYYPL-JTQLQIEISA-N. The full InChI is InChI=1S/C15H24N2O/c1-10(9-12-5-3-4-6-12)16-14-11(2)17-18-15(14)13-7-8-13/h10,12-13,16H,3-9H2,1-2H3/t10-/m0/s1.
What are the key properties of N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine?
N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine has a molecular weight of 248.37 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-cyclopentylpropan-2-yl]-5-cyclopropyl-3-methyl-1,2-oxazol-4-amine is sourced from PubChem (CID 97309834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).