(2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide

C12H24N2O — CID 104904077

IUPAC(2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide
SMILESCC(C)C[C@@H](N)C(=O)NCCCC1CC1
InChIInChI=1S/C12H24N2O/c1-9(2)8-11(13)12(15)14-7-3-4-10-5-6-10/h9-11H,3-8,13H2,1-2H3,(H,14,15)/t11-/m1/s1
InChIKeyHVABZAZUOBKRMF-LLVKDONJSA-N
MW212.34 g/mol
LogP1.67
Rot. Bonds7

About (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide

(2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide (PubChem CID 104904077) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide
PubChem CID104904077
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide
SMILESCC(C)C[C@@H](N)C(=O)NCCCC1CC1
InChIInChI=1S/C12H24N2O/c1-9(2)8-11(13)12(15)14-7-3-4-10-5-6-10/h9-11H,3-8,13H2,1-2H3,(H,14,15)/t11-/m1/s1
InChIKeyHVABZAZUOBKRMF-LLVKDONJSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-amino-N-(3-cyclopentylpropyl)-4-methylpentanamide;hydrochloride
CID 119724237
(2S)-2-amino-N-[3-(cyclopropylmethoxy)propyl]-4-methylpentanamide
CID 61155391
3-amino-N-(3-cyclopropylpropyl)butanamide
CID 115740565
(2S)-2-amino-4-methyl-N-(4-methylpentyl)pentanamide
CID 61158361
(2S)-2-amino-N-(3-cyclopentylpropyl)butanamide
CID 103795274
(2R)-2-amino-N-(3-cyclopropylpropyl)-3,3-dimethylbutanamide
CID 104876667
(2S)-2-amino-N-(3-cyclopentylpropyl)propanamide
CID 103795255
2-amino-N-(5-amino-5-oxopentyl)-4-methylpentanamide
CID 106235612
2-amino-N-(3-cyclopropylpropyl)-3-phenylpropanamide
CID 113264265
2-amino-N-(3-methoxypropyl)-4-methylpentanamide
CID 22170060
(2S)-2-amino-N-[3-(cyclopropylamino)-3-oxopropyl]-4-methylpentanamide
CID 79401066
(2S)-2-amino-4-methyl-N-(3-propan-2-yloxypropyl)pentanamide
CID 61275418

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide?
The IUPAC name of (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide (CID 104904077) is (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide.
What is the SMILES notation for (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide?
The canonical SMILES for (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide is CC(C)C[C@@H](N)C(=O)NCCCC1CC1.
What is the InChIKey of (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide?
The InChIKey is HVABZAZUOBKRMF-LLVKDONJSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(2)8-11(13)12(15)14-7-3-4-10-5-6-10/h9-11H,3-8,13H2,1-2H3,(H,14,15)/t11-/m1/s1.
What are the key properties of (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide?
(2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide has a molecular weight of 212.34 g/mol, XLogP of 1.67, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(3-cyclopropylpropyl)-4-methylpentanamide is sourced from PubChem (CID 104904077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).