(2S)-N,2-di(propan-2-yl)cyclopentan-1-amine

C11H23N — CID 90381453

IUPAC(2S)-N,2-di(propan-2-yl)cyclopentan-1-amine
SMILESCC(C)NC1CCC[C@H]1C(C)C
InChIInChI=1S/C11H23N/c1-8(2)10-6-5-7-11(10)12-9(3)4/h8-12H,5-7H2,1-4H3/t10-,11?/m0/s1
InChIKeyCKKOCKYYOHZJAE-VUWPPUDQSA-N
MW169.31 g/mol
LogP2.81
Rot. Bonds3

About (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine

(2S)-N,2-di(propan-2-yl)cyclopentan-1-amine (PubChem CID 90381453) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name(2S)-N,2-di(propan-2-yl)cyclopentan-1-amine
PubChem CID90381453
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name(2S)-N,2-di(propan-2-yl)cyclopentan-1-amine
SMILESCC(C)NC1CCC[C@H]1C(C)C
InChIInChI=1S/C11H23N/c1-8(2)10-6-5-7-11(10)12-9(3)4/h8-12H,5-7H2,1-4H3/t10-,11?/m0/s1
InChIKeyCKKOCKYYOHZJAE-VUWPPUDQSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Cyclopentamine
CID 7608
Octamylamine
CID 10406
Iproheptine
CID 19917
Cyclopentamine Hydrochloride
CID 92798
2-(2-Methylpropyl)pyrrolidine
CID 3613277
N,6-Dimethyl-2-heptanamine
CID 10415
N-Isopropyl-6-methyl-2-heptylamine hydrochloride
CID 19916
2-Sec-butylpyrrolidine
CID 3563411
2-heptanamine, 6-methyl-n-(1-methylethyl)-, Hydrochloride (1:1)
CID 23724800
N,2-dimethylcyclopentan-1-amine
CID 15741635
2-(2-Ethylhexyl)pyrrolidine
CID 22627827
rac-(1R,2S)-2-(propan-2-yl)cyclopentan-1-amine
CID 54050131

Frequently Asked Questions

What is the IUPAC name of (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine?
The IUPAC name of (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine (CID 90381453) is (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine.
What is the SMILES notation for (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine?
The canonical SMILES for (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine is CC(C)NC1CCC[C@H]1C(C)C.
What is the InChIKey of (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine?
The InChIKey is CKKOCKYYOHZJAE-VUWPPUDQSA-N. The full InChI is InChI=1S/C11H23N/c1-8(2)10-6-5-7-11(10)12-9(3)4/h8-12H,5-7H2,1-4H3/t10-,11?/m0/s1.
What are the key properties of (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine?
(2S)-N,2-di(propan-2-yl)cyclopentan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,2-di(propan-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 90381453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).