trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine

C9H19N — CID 55289923

IUPACtrans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine
SMILESC[C@H]1CC[C@@](C)(N)C1(C)C
InChIInChI=1S/C9H19N/c1-7-5-6-9(4,10)8(7,2)3/h7H,5-6,10H2,1-4H3/t7-,9+/m0/s1
InChIKeyFCXBGDZPQCTUAV-IONNQARKSA-N
MW141.26 g/mol
LogP2.16
Rot. Bonds

About trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine

trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine (PubChem CID 55289923) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine.

Molecular Properties

Compound Nametrans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine
PubChem CID55289923
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Nametrans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine
SMILESC[C@H]1CC[C@@](C)(N)C1(C)C
InChIInChI=1S/C9H19N/c1-7-5-6-9(4,10)8(7,2)3/h7H,5-6,10H2,1-4H3/t7-,9+/m0/s1
InChIKeyFCXBGDZPQCTUAV-IONNQARKSA-N
XLogP2.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,2-Trimethylcyclopentan-1-amine hydrochloride
CID 137943600
7,7-Dimethylbicyclo[2.2.1]heptan-1-amine
CID 20356317
1,2,2-Trimethylcyclopentan-1-amine
CID 19752057
cis-(1S,3R)-1-amino-2,2,3-trimethylcyclopentane-1-carbonitrile
CID 135012151
2,4,4-Trimethyl-1-(trifluoromethyl)cyclopentan-1-amine
CID 106664135
1-(Difluoromethyl)-2,4,4-trimethylcyclopentan-1-amine
CID 106664139
5,5-Dimethylbicyclo[2.1.1]hexan-1-amine;hydrochloride
CID 170914942
3-(2-Aminoethyl)-1,2,2-trimethylcyclopentan-1-amine
CID 13574695
1-Tert-butylcyclopentan-1-amine
CID 19752059
3-(Aminomethyl)-3-ethyl-1,2-dimethylcyclopentan-1-amine
CID 19989097
4-(2-Tert-butylcyclopentyl)-2-methylbutan-2-amine
CID 20164428
1-[2-(2,2,5,5-Tetramethylcyclopentyl)ethyl]cyclopropan-1-amine
CID 20164430

Frequently Asked Questions

What is the IUPAC name of trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine?
The IUPAC name of trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine (CID 55289923) is trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine.
What is the SMILES notation for trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine?
The canonical SMILES for trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine is C[C@H]1CC[C@@](C)(N)C1(C)C.
What is the InChIKey of trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine?
The InChIKey is FCXBGDZPQCTUAV-IONNQARKSA-N. The full InChI is InChI=1S/C9H19N/c1-7-5-6-9(4,10)8(7,2)3/h7H,5-6,10H2,1-4H3/t7-,9+/m0/s1.
What are the key properties of trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine?
trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.16, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,3S)-1,2,2,3-tetramethylcyclopentan-1-amine is sourced from PubChem (CID 55289923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).