(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide

C17H33N3O2 — CID 56875780

IUPAC(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
SMILESCC(C)C[C@@H](N)C(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C17H33N3O2/c1-14(2)12-15(18)16(21)19-13-17(6-4-3-5-7-17)20-8-10-22-11-9-20/h14-15H,3-13,18H2,1-2H3,(H,19,21)/t15-/m1/s1
InChIKeyIZUZOOVNXAOFCS-OAHLLOKOSA-N
MW311.47 g/mol
LogP1.51
Rot. Bonds6

About (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide

(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide (PubChem CID 56875780) has the molecular formula C17H33N3O2 and a molecular weight of 311.47 g/mol. Its IUPAC name is (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
PubChem CID56875780
Molecular FormulaC17H33N3O2
Molecular Weight311.47 g/mol
Exact Mass311.26
IUPAC Name(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
SMILESCC(C)C[C@@H](N)C(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C17H33N3O2/c1-14(2)12-15(18)16(21)19-13-17(6-4-3-5-7-17)20-8-10-22-11-9-20/h14-15H,3-13,18H2,1-2H3,(H,19,21)/t15-/m1/s1
InChIKeyIZUZOOVNXAOFCS-OAHLLOKOSA-N
XLogP1.51
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.47
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide?
The IUPAC name of (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide (CID 56875780) is (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide.
What is the SMILES notation for (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide?
The canonical SMILES for (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide is CC(C)C[C@@H](N)C(=O)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide?
The InChIKey is IZUZOOVNXAOFCS-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H33N3O2/c1-14(2)12-15(18)16(21)19-13-17(6-4-3-5-7-17)20-8-10-22-11-9-20/h14-15H,3-13,18H2,1-2H3,(H,19,21)/t15-/m1/s1.
What are the key properties of (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide?
(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide has a molecular weight of 311.47 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide is sourced from PubChem (CID 56875780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).