5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine

C12H20N2O — CID 79412982

IUPAC5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine
SMILESCCCc1c(N)noc1CC1CCCC1
InChIInChI=1S/C12H20N2O/c1-2-5-10-11(15-14-12(10)13)8-9-6-3-4-7-9/h9H,2-8H2,1H3,(H2,13,14)
InChIKeyBASFYBWJBHWEFR-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.94
Rot. Bonds4

About 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine

5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine (PubChem CID 79412982) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine
PubChem CID79412982
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine
SMILESCCCc1c(N)noc1CC1CCCC1
InChIInChI=1S/C12H20N2O/c1-2-5-10-11(15-14-12(10)13)8-9-6-3-4-7-9/h9H,2-8H2,1H3,(H2,13,14)
InChIKeyBASFYBWJBHWEFR-UHFFFAOYSA-N
XLogP2.94
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
CID 66200058
4-bromo-5-(cyclobutylmethyl)-1,2-oxazol-3-amine
CID 103167459
5-(cyclopentylmethyl)-4-iodo-1,2-oxazol-3-amine
CID 79557646
5-(2-cyclohexylethyl)-4-methyl-1,2-oxazol-3-amine
CID 66198399
4-ethyl-5-propyl-1,2-oxazol-3-amine
CID 66198038
5-[(1-methoxycyclobutyl)methyl]-4-propyl-1,2-oxazol-3-amine
CID 103558607
5-(cyclohexylmethyl)-4-phenyl-1,2-oxazol-3-amine
CID 66198710
5-(cyclobutylmethyl)-4-(4-fluorophenyl)-1,2-oxazol-3-amine
CID 103167415
4-(4-chlorophenyl)-5-(cyclopentylmethyl)-1,2-oxazol-3-amine
CID 66200930
5-(3-phenylpropyl)-4-propyl-1,2-oxazol-3-amine
CID 79412877
5-(cyclobutylmethyl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
CID 103167445
5-(cycloheptylmethyl)-4-(4-fluorophenyl)-1,2-oxazol-3-amine
CID 114459367

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine?
The IUPAC name of 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine (CID 79412982) is 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine?
The canonical SMILES for 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine is CCCc1c(N)noc1CC1CCCC1.
What is the InChIKey of 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine?
The InChIKey is BASFYBWJBHWEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-2-5-10-11(15-14-12(10)13)8-9-6-3-4-7-9/h9H,2-8H2,1H3,(H2,13,14).
What are the key properties of 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine?
5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine has a molecular weight of 208.30 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopentylmethyl)-4-propyl-1,2-oxazol-3-amine is sourced from PubChem (CID 79412982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).