(3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine

C11H21N — CID 134195604

IUPAC(3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine
SMILESC[C@H]1C[C@H](C)CN(CC2CC2)C1
InChIInChI=1S/C11H21N/c1-9-5-10(2)7-12(6-9)8-11-3-4-11/h9-11H,3-8H2,1-2H3/t9-,10-/m0/s1
InChIKeyOGHXSZDNLVADKD-UWVGGRQHSA-N
MW167.30 g/mol
LogP2.37
Rot. Bonds2

About (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine

(3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine (PubChem CID 134195604) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine.

Molecular Properties

Compound Name(3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine
PubChem CID134195604
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name(3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine
SMILESC[C@H]1C[C@H](C)CN(CC2CC2)C1
InChIInChI=1S/C11H21N/c1-9-5-10(2)7-12(6-9)8-11-3-4-11/h9-11H,3-8H2,1-2H3/t9-,10-/m0/s1
InChIKeyOGHXSZDNLVADKD-UWVGGRQHSA-N
XLogP2.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[4-[(3,5-dimethylpiperidin-1-yl)methyl]cyclohexyl]methanamine
CID 79527069
(3S,5S)-1-(cyclopropylmethyl)-5-methylpiperidine-3-thiol
CID 134203251
(3S,5R)-1-(cyclopropylmethyl)-5-methylpiperidin-3-ol
CID 130856207
1-(cyclopentylmethyl)-3-methylazetidine;ethane
CID 170635861
1-(cyclopropylmethyl)-3-methylpyrrolidine
CID 66698418
5-methyl-1-[(4-methylcyclohexyl)methyl]piperidine-3-carboxylic acid
CID 122125296
1-(cyclopropylmethyl)-5-methyl-N-(3-methylbutyl)piperidin-3-amine
CID 83995984
1-(cyclopentylmethyl)-N-cyclopropyl-5-methylpiperidin-3-amine
CID 83991895
(2S,6S)-4-(cyclopropylmethyl)-1,2,6-trimethylpiperazine
CID 174261411
1-(cyclohexylmethyl)-N-cyclopropyl-5-methylpiperidin-3-amine
CID 83991902
N-cyclohexyl-1-(cyclopentylmethyl)-5-methylpiperidin-3-amine
CID 83999504
1-(cyclopropylmethyl)-4-methylpiperidine
CID 54039585

Frequently Asked Questions

What is the IUPAC name of (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine?
The IUPAC name of (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine (CID 134195604) is (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine.
What is the SMILES notation for (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine?
The canonical SMILES for (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine is C[C@H]1C[C@H](C)CN(CC2CC2)C1.
What is the InChIKey of (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine?
The InChIKey is OGHXSZDNLVADKD-UWVGGRQHSA-N. The full InChI is InChI=1S/C11H21N/c1-9-5-10(2)7-12(6-9)8-11-3-4-11/h9-11H,3-8H2,1-2H3/t9-,10-/m0/s1.
What are the key properties of (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine?
(3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine has a molecular weight of 167.30 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,5S)-1-(cyclopropylmethyl)-3,5-dimethylpiperidine is sourced from PubChem (CID 134195604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).