2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine

C12H26N2 — CID 124635830

IUPAC2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine
SMILESCC(C)CN1CCCC[C@H]1C(C)(C)N
InChIInChI=1S/C12H26N2/c1-10(2)9-14-8-6-5-7-11(14)12(3,4)13/h10-11H,5-9,13H2,1-4H3/t11-/m0/s1
InChIKeyNZGYAZPMZVKLDP-NSHDSACASA-N
MW198.35 g/mol
LogP2.23
Rot. Bonds3

About 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine

2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine (PubChem CID 124635830) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine.

Molecular Properties

Compound Name2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine
PubChem CID124635830
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine
SMILESCC(C)CN1CCCC[C@H]1C(C)(C)N
InChIInChI=1S/C12H26N2/c1-10(2)9-14-8-6-5-7-11(14)12(3,4)13/h10-11H,5-9,13H2,1-4H3/t11-/m0/s1
InChIKeyNZGYAZPMZVKLDP-NSHDSACASA-N
XLogP2.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2-methylpropyl)piperidin-2-yl]propan-2-amine
CID 58691416
[(2R,3R)-2-ethyl-1-(2-methylpropyl)azepan-3-yl]methanamine
CID 96612828
2-(bromomethyl)-1-(2-methylpropyl)azepane
CID 116638294
1-(2-methylpropyl)-3,4,6,7,8,9,10,10a-octahydro-2H-pyrimido[1,2-a]azepine
CID 126695178
1-cyclopentyl-2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine
CID 83982273
2-[1-(2-methylpropyl)piperidin-2-yl]ethanol
CID 62021194
2,2-dimethyl-N-[[(2R)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]propan-1-amine
CID 103838761
1-[1-(2-methylpropyl)piperidin-2-yl]propan-2-one
CID 79537849
2-tert-butyl-1-(2,2-dimethylpropyl)piperidine
CID 177261247
beryllium;ethane;2-methanidyl-1-(2-methylpropyl)pyrrolidine
CID 173479444
(2R)-2-(fluoromethyl)-1-(2-methylpropyl)pyrrolidine
CID 165411366
trimethyl-[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]silane
CID 11356096

Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine?
The IUPAC name of 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine (CID 124635830) is 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine.
What is the SMILES notation for 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine?
The canonical SMILES for 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine is CC(C)CN1CCCC[C@H]1C(C)(C)N.
What is the InChIKey of 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine?
The InChIKey is NZGYAZPMZVKLDP-NSHDSACASA-N. The full InChI is InChI=1S/C12H26N2/c1-10(2)9-14-8-6-5-7-11(14)12(3,4)13/h10-11H,5-9,13H2,1-4H3/t11-/m0/s1.
What are the key properties of 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine?
2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine has a molecular weight of 198.35 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]propan-2-amine is sourced from PubChem (CID 124635830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).