1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid

C14H26N2O3 — CID 65292395

IUPAC1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid
SMILESCC(C)(CCN)CCC(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C14H26N2O3/c1-13(2,9-10-15)8-5-11(17)16-14(12(18)19)6-3-4-7-14/h3-10,15H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyCHNZUWLOUQCXTH-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.66
Rot. Bonds7

About 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid

1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 65292395) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid
PubChem CID65292395
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid
SMILESCC(C)(CCN)CCC(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C14H26N2O3/c1-13(2,9-10-15)8-5-11(17)16-14(12(18)19)6-3-4-7-14/h3-10,15H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyCHNZUWLOUQCXTH-UHFFFAOYSA-N
XLogP1.66
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclohexane-1-carboxylic acid
CID 65292201
1-[[4-(2-aminoethyl)-5,5-dimethylhexanoyl]amino]cyclobutane-1-carboxylic acid
CID 81162326
1-[[(6-amino-4,4-dimethylhexanoyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 115445871
1-(3-carboxypropanoylamino)cyclopentane-1-carboxylic acid
CID 13376659
1-[(3-amino-3-methylbutanoyl)amino]cyclohexane-1-carboxylic acid
CID 64676761
1-(5,5-dimethylhexanoylamino)cyclopropane-1-carboxylic acid
CID 115910145
1-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid
CID 22574849
1-(butanoylamino)cyclobutane-1-carboxylic acid
CID 81158952
1-[3-(propan-2-ylamino)propanoylamino]cyclopentane-1-carboxylic acid
CID 61160411
1-[(4,4,4-trifluoro-3,3-dimethylbutanoyl)amino]cyclohexane-1-carboxylic acid
CID 120666261
1-(hexanoylamino)cycloheptane-1-carboxylic acid
CID 43341577
1-(pentanoylamino)cyclobutane-1-carboxylic acid
CID 81164926

Frequently Asked Questions

What is the IUPAC name of 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid (CID 65292395) is 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid is CC(C)(CCN)CCC(=O)NC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is CHNZUWLOUQCXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-13(2,9-10-15)8-5-11(17)16-14(12(18)19)6-3-4-7-14/h3-10,15H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid?
1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 270.37 g/mol, XLogP of 1.66, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 65292395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).