5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid

C14H25NO2 — CID 65254953

IUPAC5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid
SMILESCC(C)(CCCN(CC1CC1)C1CC1)C(=O)O
InChIInChI=1S/C14H25NO2/c1-14(2,13(16)17)8-3-9-15(12-6-7-12)10-11-4-5-11/h11-12H,3-10H2,1-2H3,(H,16,17)
InChIKeyOGJBCSFKZGAFRD-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.75
Rot. Bonds8

About 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid

5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid (PubChem CID 65254953) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid.

Molecular Properties

Compound Name5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid
PubChem CID65254953
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid
SMILESCC(C)(CCCN(CC1CC1)C1CC1)C(=O)O
InChIInChI=1S/C14H25NO2/c1-14(2,13(16)17)8-3-9-15(12-6-7-12)10-11-4-5-11/h11-12H,3-10H2,1-2H3,(H,16,17)
InChIKeyOGJBCSFKZGAFRD-UHFFFAOYSA-N
XLogP2.75
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylamino)-5-[cyclopropyl(cyclopropylmethyl)amino]-2-ethylpentanoic acid
CID 106806318
5-[cyclopropyl(cyclopropylmethyl)amino]-2-ethyl-2-(propan-2-ylamino)pentanoic acid
CID 106806317
2-(cyclopropylamino)-6-[cyclopropyl(cyclopropylmethyl)amino]-2-methylhexanoic acid
CID 64521035
5-[cyclopentylmethyl(methyl)amino]-2,2-dimethylpentanoic acid
CID 65254595
4-[cyclopropyl(ethyl)amino]-2,2-dimethylbutanoic acid
CID 65248437
6-[cyclopropyl(cyclopropylmethyl)amino]-2-methyl-2-(methylamino)hexanamide
CID 64522437
5-[cyclopropyl(thiophen-3-ylmethyl)amino]-2,2-dimethylpentanoic acid
CID 65255298
tert-butyl 3-[cyclopropyl(cyclopropylmethyl)amino]propanoate
CID 115609763
2-(cyclopropylamino)-5-[cyclopropyl(cyclopropylmethyl)amino]-2-methylpentanenitrile
CID 64520439
2-(cyclopropylamino)-4-[cyclopropyl(cyclopropylmethyl)amino]-2-methylbutanamide
CID 64520054
4-[cyclohexyl(ethyl)amino]-2,2-dimethylbutanoic acid
CID 65248233
1-[cyclopropyl(cyclopropylmethyl)amino]propan-2-one
CID 64522765

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid?
The IUPAC name of 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid (CID 65254953) is 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid.
What is the SMILES notation for 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid?
The canonical SMILES for 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid is CC(C)(CCCN(CC1CC1)C1CC1)C(=O)O.
What is the InChIKey of 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid?
The InChIKey is OGJBCSFKZGAFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-14(2,13(16)17)8-3-9-15(12-6-7-12)10-11-4-5-11/h11-12H,3-10H2,1-2H3,(H,16,17).
What are the key properties of 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid?
5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid has a molecular weight of 239.36 g/mol, XLogP of 2.75, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(cyclopropylmethyl)amino]-2,2-dimethylpentanoic acid is sourced from PubChem (CID 65254953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).