3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

C14H23N3O3 — CID 71844692

IUPAC3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SMILESCc1cc(NC(=O)CCN(C)CC2(O)CCCC2)no1
InChIInChI=1S/C14H23N3O3/c1-11-9-12(16-20-11)15-13(18)5-8-17(2)10-14(19)6-3-4-7-14/h9,19H,3-8,10H2,1-2H3,(H,15,16,18)
InChIKeyOONXUGUANJGYPU-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.55
Rot. Bonds6

About 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide (PubChem CID 71844692) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide.

Molecular Properties

Compound Name3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
PubChem CID71844692
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SMILESCc1cc(NC(=O)CCN(C)CC2(O)CCCC2)no1
InChIInChI=1S/C14H23N3O3/c1-11-9-12(16-20-11)15-13(18)5-8-17(2)10-14(19)6-3-4-7-14/h9,19H,3-8,10H2,1-2H3,(H,15,16,18)
InChIKeyOONXUGUANJGYPU-UHFFFAOYSA-N
XLogP1.55
TPSA78.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The IUPAC name of 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide (CID 71844692) is 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide.
What is the SMILES notation for 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The canonical SMILES for 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide is Cc1cc(NC(=O)CCN(C)CC2(O)CCCC2)no1.
What is the InChIKey of 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The InChIKey is OONXUGUANJGYPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-11-9-12(16-20-11)15-13(18)5-8-17(2)10-14(19)6-3-4-7-14/h9,19H,3-8,10H2,1-2H3,(H,15,16,18).
What are the key properties of 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide has a molecular weight of 281.36 g/mol, XLogP of 1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-hydroxycyclopentyl)methyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide is sourced from PubChem (CID 71844692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).