cyclopropylmethyl 2-amino-3-methylpentanoate

C10H19NO2 — CID 61150459

IUPACcyclopropylmethyl 2-amino-3-methylpentanoate
SMILESCCC(C)C(N)C(=O)OCC1CC1
InChIInChI=1S/C10H19NO2/c1-3-7(2)9(11)10(12)13-6-8-4-5-8/h7-9H,3-6,11H2,1-2H3
InChIKeyRYCGOOUFBLRWSA-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.31
Rot. Bonds5

About cyclopropylmethyl 2-amino-3-methylpentanoate

cyclopropylmethyl 2-amino-3-methylpentanoate (PubChem CID 61150459) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is cyclopropylmethyl 2-amino-3-methylpentanoate.

Molecular Properties

Compound Namecyclopropylmethyl 2-amino-3-methylpentanoate
PubChem CID61150459
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Namecyclopropylmethyl 2-amino-3-methylpentanoate
SMILESCCC(C)C(N)C(=O)OCC1CC1
InChIInChI=1S/C10H19NO2/c1-3-7(2)9(11)10(12)13-6-8-4-5-8/h7-9H,3-6,11H2,1-2H3
InChIKeyRYCGOOUFBLRWSA-UHFFFAOYSA-N
XLogP1.31
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropylethyl 2-amino-3-methylpentanoate
CID 106202709
2-cyclopropylethyl (2S,3S)-2-amino-3-methylpentanoate
CID 106202505
cyclopropylmethyl 2-methylhexanoate
CID 67151240
cyclohexylmethyl 2-amino-3-methylbutanoate
CID 62383261
4-amino-1-cyclopropyl-5-methylheptan-3-one
CID 116552846
(2S,3S)-2-amino-N-[2-(cyclopropylmethoxy)ethyl]-3-methylpentanamide
CID 103833000
cyclopropylmethyl 2-sulfanylpropanoate
CID 107018198
cyclopropylmethyl 4-amino-2-methylbutanoate
CID 80540087
cyclopropylmethyl (2S)-2-aminopentanoate
CID 107565685
cyclopentylmethyl 2-aminobutanoate
CID 66322645
2-amino-N-[3-(cyclopropylmethoxy)propyl]-3-methylpentanamide
CID 43515321
ethyl (3R)-2-amino-3-methylpentanoate;hydrochloride
CID 169227139

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethyl 2-amino-3-methylpentanoate?
The IUPAC name of cyclopropylmethyl 2-amino-3-methylpentanoate (CID 61150459) is cyclopropylmethyl 2-amino-3-methylpentanoate.
What is the SMILES notation for cyclopropylmethyl 2-amino-3-methylpentanoate?
The canonical SMILES for cyclopropylmethyl 2-amino-3-methylpentanoate is CCC(C)C(N)C(=O)OCC1CC1.
What is the InChIKey of cyclopropylmethyl 2-amino-3-methylpentanoate?
The InChIKey is RYCGOOUFBLRWSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-7(2)9(11)10(12)13-6-8-4-5-8/h7-9H,3-6,11H2,1-2H3.
What are the key properties of cyclopropylmethyl 2-amino-3-methylpentanoate?
cyclopropylmethyl 2-amino-3-methylpentanoate has a molecular weight of 185.27 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethyl 2-amino-3-methylpentanoate is sourced from PubChem (CID 61150459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).