N-decyl-3,5-dimethyl-1,2-oxazol-4-amine

C15H28N2O — CID 150808567

IUPACN-decyl-3,5-dimethyl-1,2-oxazol-4-amine
SMILESCCCCCCCCCCNc1c(C)noc1C
InChIInChI=1S/C15H28N2O/c1-4-5-6-7-8-9-10-11-12-16-15-13(2)17-18-14(15)3/h16H,4-12H2,1-3H3
InChIKeyKHKFGHDSUXRRPO-UHFFFAOYSA-N
MW252.40 g/mol
LogP4.84
Rot. Bonds10

About N-decyl-3,5-dimethyl-1,2-oxazol-4-amine

N-decyl-3,5-dimethyl-1,2-oxazol-4-amine (PubChem CID 150808567) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-decyl-3,5-dimethyl-1,2-oxazol-4-amine.

Molecular Properties

Compound NameN-decyl-3,5-dimethyl-1,2-oxazol-4-amine
PubChem CID150808567
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-decyl-3,5-dimethyl-1,2-oxazol-4-amine
SMILESCCCCCCCCCCNc1c(C)noc1C
InChIInChI=1S/C15H28N2O/c1-4-5-6-7-8-9-10-11-12-16-15-13(2)17-18-14(15)3/h16H,4-12H2,1-3H3
InChIKeyKHKFGHDSUXRRPO-UHFFFAOYSA-N
XLogP4.84
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 54.84
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

N-butyl-3,4-dimethyl-1,2-oxazol-5-amine
CID 154191592
3,5-dimethyl-N-(2-methylbutan-2-yl)-1,2-oxazol-4-amine
CID 155244298
3,5-dimethyl-4-(7-methyltetradecan-7-yl)-1,2-oxazole
CID 137470392
3,5-dimethyl-4-pentadecan-8-yl-1,2-oxazole
CID 130325174
5-methyl-N-octylpyrimidin-2-amine
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2,4-dimethyl-3-N-tetradecylbenzene-1,3,5-triamine
CID 87803959
5-N,6-N-dihexyl-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
CID 122192878
(2S)-N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(propylamino)propanamide
CID 76851958
N-butyl-3,5-dimethyl-1H-pyrazol-4-amine
CID 43547243
2,6-diethyl-N-octylaniline
CID 63491055
2,6-dibromo-N-decylaniline
CID 107599083

Frequently Asked Questions

What is the IUPAC name of N-decyl-3,5-dimethyl-1,2-oxazol-4-amine?
The IUPAC name of N-decyl-3,5-dimethyl-1,2-oxazol-4-amine (CID 150808567) is N-decyl-3,5-dimethyl-1,2-oxazol-4-amine.
What is the SMILES notation for N-decyl-3,5-dimethyl-1,2-oxazol-4-amine?
The canonical SMILES for N-decyl-3,5-dimethyl-1,2-oxazol-4-amine is CCCCCCCCCCNc1c(C)noc1C.
What is the InChIKey of N-decyl-3,5-dimethyl-1,2-oxazol-4-amine?
The InChIKey is KHKFGHDSUXRRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-4-5-6-7-8-9-10-11-12-16-15-13(2)17-18-14(15)3/h16H,4-12H2,1-3H3.
What are the key properties of N-decyl-3,5-dimethyl-1,2-oxazol-4-amine?
N-decyl-3,5-dimethyl-1,2-oxazol-4-amine has a molecular weight of 252.40 g/mol, XLogP of 4.84, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-3,5-dimethyl-1,2-oxazol-4-amine is sourced from PubChem (CID 150808567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).