(2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one

C10H19NO — CID 138478497

IUPAC(2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one
SMILESCC(C)C[C@@H](N)C(=O)C1(C)CC1
InChIInChI=1S/C10H19NO/c1-7(2)6-8(11)9(12)10(3)4-5-10/h7-8H,4-6,11H2,1-3H3/t8-/m1/s1
InChIKeyMPCOCNMISXVNBM-MRVPVSSYSA-N
MW169.27 g/mol
LogP1.73
Rot. Bonds4

About (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one

(2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one (PubChem CID 138478497) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one
PubChem CID138478497
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one
SMILESCC(C)C[C@@H](N)C(=O)C1(C)CC1
InChIInChI=1S/C10H19NO/c1-7(2)6-8(11)9(12)10(3)4-5-10/h7-8H,4-6,11H2,1-3H3/t8-/m1/s1
InChIKeyMPCOCNMISXVNBM-MRVPVSSYSA-N
XLogP1.73
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one?
The IUPAC name of (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one (CID 138478497) is (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one.
What is the SMILES notation for (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one?
The canonical SMILES for (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one is CC(C)C[C@@H](N)C(=O)C1(C)CC1.
What is the InChIKey of (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one?
The InChIKey is MPCOCNMISXVNBM-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)6-8(11)9(12)10(3)4-5-10/h7-8H,4-6,11H2,1-3H3/t8-/m1/s1.
What are the key properties of (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one?
(2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one has a molecular weight of 169.27 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4-methyl-1-(1-methylcyclopropyl)pentan-1-one is sourced from PubChem (CID 138478497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).