(3R)-1-tert-butyl-3-propylpiperidine

C12H25N — CID 171581901

IUPAC(3R)-1-tert-butyl-3-propylpiperidine
SMILESCCC[C@@H]1CCCN(C(C)(C)C)C1
InChIInChI=1S/C12H25N/c1-5-7-11-8-6-9-13(10-11)12(2,3)4/h11H,5-10H2,1-4H3/t11-/m1/s1
InChIKeyRBQALCCJKOBDBX-LLVKDONJSA-N
MW183.34 g/mol
LogP3.30
Rot. Bonds2

About (3R)-1-tert-butyl-3-propylpiperidine

(3R)-1-tert-butyl-3-propylpiperidine (PubChem CID 171581901) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is (3R)-1-tert-butyl-3-propylpiperidine.

Molecular Properties

Compound Name(3R)-1-tert-butyl-3-propylpiperidine
PubChem CID171581901
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name(3R)-1-tert-butyl-3-propylpiperidine
SMILESCCC[C@@H]1CCCN(C(C)(C)C)C1
InChIInChI=1S/C12H25N/c1-5-7-11-8-6-9-13(10-11)12(2,3)4/h11H,5-10H2,1-4H3/t11-/m1/s1
InChIKeyRBQALCCJKOBDBX-LLVKDONJSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3R)-1-tert-butyl-3-propylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-tert-butyl-3-(2-methylpropyl)piperidine
CID 170069578
1-tert-butyl-4-[[(3R)-1-tert-butylpiperidin-3-yl]methyl]piperazine
CID 156550929
(1-tert-butylazepan-3-yl)methanamine
CID 84659780
1-tert-butyl-3-(2,3,3-trimethylbutyl)piperidine
CID 176842011
[(3S)-1-tert-butylpiperidin-3-yl]methyl methanesulfonate
CID 164945767
propylcyclotetradecane
CID 90991550
3-(2,2-dimethylpropyl)-1-(2-methylbutan-2-yl)piperidine
CID 143176562
(3R,4S)-1-tert-butyl-3-propylpiperidin-4-ol
CID 171581949
(3S,4S)-1-tert-butyl-3-propylpiperidin-4-ol
CID 171581887
(3S,4R)-1-tert-butyl-3-propylpiperidin-4-ol
CID 171581981
3-propylpiperidine-1-carboxamide
CID 18466872
1,3-ditert-butylpiperidine;methane
CID 157116364

Frequently Asked Questions

What is the IUPAC name of (3R)-1-tert-butyl-3-propylpiperidine?
The IUPAC name of (3R)-1-tert-butyl-3-propylpiperidine (CID 171581901) is (3R)-1-tert-butyl-3-propylpiperidine.
What is the SMILES notation for (3R)-1-tert-butyl-3-propylpiperidine?
The canonical SMILES for (3R)-1-tert-butyl-3-propylpiperidine is CCC[C@@H]1CCCN(C(C)(C)C)C1.
What is the InChIKey of (3R)-1-tert-butyl-3-propylpiperidine?
The InChIKey is RBQALCCJKOBDBX-LLVKDONJSA-N. The full InChI is InChI=1S/C12H25N/c1-5-7-11-8-6-9-13(10-11)12(2,3)4/h11H,5-10H2,1-4H3/t11-/m1/s1.
What are the key properties of (3R)-1-tert-butyl-3-propylpiperidine?
(3R)-1-tert-butyl-3-propylpiperidine has a molecular weight of 183.34 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-tert-butyl-3-propylpiperidine is sourced from PubChem (CID 171581901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).