N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine

C16H27N3O — CID 106370378

IUPACN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESCc1nc(CNC2CCCC2C2CCCCN2)oc1C
InChIInChI=1S/C16H27N3O/c1-11-12(2)20-16(19-11)10-18-15-8-5-6-13(15)14-7-3-4-9-17-14/h13-15,17-18H,3-10H2,1-2H3
InChIKeyFVDPEIBGUGJADR-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.69
Rot. Bonds4

About N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine

N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine (PubChem CID 106370378) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
PubChem CID106370378
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESCc1nc(CNC2CCCC2C2CCCCN2)oc1C
InChIInChI=1S/C16H27N3O/c1-11-12(2)20-16(19-11)10-18-15-8-5-6-13(15)14-7-3-4-9-17-14/h13-15,17-18H,3-10H2,1-2H3
InChIKeyFVDPEIBGUGJADR-UHFFFAOYSA-N
XLogP2.69
TPSA50.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
The IUPAC name of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine (CID 106370378) is N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine.
What is the SMILES notation for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
The canonical SMILES for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine is Cc1nc(CNC2CCCC2C2CCCCN2)oc1C.
What is the InChIKey of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
The InChIKey is FVDPEIBGUGJADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-11-12(2)20-16(19-11)10-18-15-8-5-6-13(15)14-7-3-4-9-17-14/h13-15,17-18H,3-10H2,1-2H3.
What are the key properties of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine?
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine has a molecular weight of 277.41 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine is sourced from PubChem (CID 106370378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).