(3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine

C14H27N — CID 167196358

IUPAC(3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine
SMILESCC(C)CC1(CN2CCC[C@@H](C)C2)CC1
InChIInChI=1S/C14H27N/c1-12(2)9-14(6-7-14)11-15-8-4-5-13(3)10-15/h12-13H,4-11H2,1-3H3/t13-/m1/s1
InChIKeyHCDXGIYKJRPFPY-CYBMUJFWSA-N
MW209.38 g/mol
LogP3.54
Rot. Bonds4

About (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine

(3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine (PubChem CID 167196358) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine.

Molecular Properties

Compound Name(3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine
PubChem CID167196358
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name(3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine
SMILESCC(C)CC1(CN2CCC[C@@H](C)C2)CC1
InChIInChI=1S/C14H27N/c1-12(2)9-14(6-7-14)11-15-8-4-5-13(3)10-15/h12-13H,4-11H2,1-3H3/t13-/m1/s1
InChIKeyHCDXGIYKJRPFPY-CYBMUJFWSA-N
XLogP3.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-[(3-methylpiperidin-1-yl)methyl]cyclopropyl]acetonitrile
CID 65495067
N-[[4-[(3-methylpiperidin-1-yl)methyl]oxan-4-yl]methyl]propan-2-amine
CID 55066136
[4-[(3-methylpiperidin-1-yl)methyl]oxan-4-yl]methanol
CID 62391715
(3R)-3-methyl-1-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]pyrrolidine
CID 175612155
N-[[1-[(3-methylpiperidin-1-yl)methyl]cyclopentyl]methyl]propan-1-amine
CID 55051948
2-[[1-[[(3R)-3-methylpiperidin-1-yl]methyl]cyclopropyl]methoxy]pyridine
CID 175851042
1-(3-methylpiperidin-1-yl)propan-2-ol
CID 60886125
1-(2,3-dimethylbutyl)-3-methylpiperidine
CID 174315397
3-methyl-1-(2,2,4-trimethylpentyl)piperidine
CID 118299028
2-[1-[(4-methylazepan-1-yl)methyl]cyclopropyl]ethanamine
CID 65479951
1-butan-2-yl-4-[[(3R)-1-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidin-3-yl]methyl]piperazine
CID 174276613
ethane;1-ethyl-3-methylpiperidine
CID 91361629

Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine?
The IUPAC name of (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine (CID 167196358) is (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine.
What is the SMILES notation for (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine?
The canonical SMILES for (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine is CC(C)CC1(CN2CCC[C@@H](C)C2)CC1.
What is the InChIKey of (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine?
The InChIKey is HCDXGIYKJRPFPY-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H27N/c1-12(2)9-14(6-7-14)11-15-8-4-5-13(3)10-15/h12-13H,4-11H2,1-3H3/t13-/m1/s1.
What are the key properties of (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine?
(3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine has a molecular weight of 209.38 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-1-[[1-(2-methylpropyl)cyclopropyl]methyl]piperidine is sourced from PubChem (CID 167196358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).