N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide

C19H30N2O2 — CID 47005479

IUPACN-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide
SMILESCCCC(C(=O)NCC(C)(C)N1CCOCC1)c1ccccc1
InChIInChI=1S/C19H30N2O2/c1-4-8-17(16-9-6-5-7-10-16)18(22)20-15-19(2,3)21-11-13-23-14-12-21/h5-7,9-10,17H,4,8,11-15H2,1-3H3,(H,20,22)
InChIKeyKIOSEXMAWCWEST-UHFFFAOYSA-N
MW318.46 g/mol
LogP2.80
Rot. Bonds7

About N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide

N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide (PubChem CID 47005479) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide.

Molecular Properties

Compound NameN-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide
PubChem CID47005479
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC NameN-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide
SMILESCCCC(C(=O)NCC(C)(C)N1CCOCC1)c1ccccc1
InChIInChI=1S/C19H30N2O2/c1-4-8-17(16-9-6-5-7-10-16)18(22)20-15-19(2,3)21-11-13-23-14-12-21/h5-7,9-10,17H,4,8,11-15H2,1-3H3,(H,20,22)
InChIKeyKIOSEXMAWCWEST-UHFFFAOYSA-N
XLogP2.80
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide?
The IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide (CID 47005479) is N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide.
What is the SMILES notation for N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide?
The canonical SMILES for N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide is CCCC(C(=O)NCC(C)(C)N1CCOCC1)c1ccccc1.
What is the InChIKey of N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide?
The InChIKey is KIOSEXMAWCWEST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-4-8-17(16-9-6-5-7-10-16)18(22)20-15-19(2,3)21-11-13-23-14-12-21/h5-7,9-10,17H,4,8,11-15H2,1-3H3,(H,20,22).
What are the key properties of N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide?
N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide has a molecular weight of 318.46 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenylpentanamide is sourced from PubChem (CID 47005479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).