cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid

C10H19NO2 — CID 99989227

IUPACcis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid
SMILESCC1(C)[C@](C)(C(=O)O)CC[C@@]1(C)N
InChIInChI=1S/C10H19NO2/c1-8(2)9(3,7(12)13)5-6-10(8,4)11/h5-6,11H2,1-4H3,(H,12,13)/t9-,10+/m0/s1
InChIKeyXHQZLSSHEHQBBO-VHSXEESVSA-N
MW185.27 g/mol
LogP1.61
Rot. Bonds1

About cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid

cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid (PubChem CID 99989227) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid.

Molecular Properties

Compound Namecis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid
PubChem CID99989227
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Namecis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid
SMILESCC1(C)[C@](C)(C(=O)O)CC[C@@]1(C)N
InChIInChI=1S/C10H19NO2/c1-8(2)9(3,7(12)13)5-6-10(8,4)11/h5-6,11H2,1-4H3,(H,12,13)/t9-,10+/m0/s1
InChIKeyXHQZLSSHEHQBBO-VHSXEESVSA-N
XLogP1.61
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid
CID 102568279
trans-(1S,3S)-1-bromo-2,2,3-trimethylcyclopentane-1,3-dicarboxylic acid
CID 927623
1,2,3,4-tetramethylcyclohexane-1,2,3,4-tetracarboxylic acid
CID 175458991
(1S)-1,2,2-trimethylcyclopentane-1-carboxylic acid
CID 11805005
3-(cyclohexylcarbamoyl)-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid
CID 4729444
trans-(1S,3R)-1-(2,2,3,3,4,4,4-heptafluorobutanoyl)-2,2,3-trimethylcyclopentane-1,3-dicarboxylic acid
CID 170924192
(1R)-2,2-dichloro-1-methylcyclopropane-1-carboxylic acid
CID 7003716
(1S)-2,2-difluoro-1-methylcyclopropane-1-carboxylic acid
CID 86313116
3-[(3,5-dichlorophenyl)carbamoyl]-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid
CID 4729426
1-amino-2-methyl-2-methylsulfanylcyclohexane-1-carboxylic acid
CID 20552391
3-amino-2-hydroxy-1,2-dimethylcyclohexane-1-carboxylic acid
CID 67284908
(E)-3-(1-aminocyclopropyl)prop-2-enoic acid
CID 6438535

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid?
The IUPAC name of cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid (CID 99989227) is cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid.
What is the SMILES notation for cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid?
The canonical SMILES for cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid is CC1(C)[C@](C)(C(=O)O)CC[C@@]1(C)N.
What is the InChIKey of cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid?
The InChIKey is XHQZLSSHEHQBBO-VHSXEESVSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8(2)9(3,7(12)13)5-6-10(8,4)11/h5-6,11H2,1-4H3,(H,12,13)/t9-,10+/m0/s1.
What are the key properties of cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid?
cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid has a molecular weight of 185.27 g/mol, XLogP of 1.61, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3R)-3-amino-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid is sourced from PubChem (CID 99989227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).