N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine

C11H22N2S — CID 43296815

IUPACN-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine
SMILESCN(CC1CCCCN1)C1CCSC1
InChIInChI=1S/C11H22N2S/c1-13(11-5-7-14-9-11)8-10-4-2-3-6-12-10/h10-12H,2-9H2,1H3
InChIKeyMGAFKTCVJHEVQJ-UHFFFAOYSA-N
MW214.38 g/mol
LogP1.57
Rot. Bonds3

About N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine

N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine (PubChem CID 43296815) has the molecular formula C11H22N2S and a molecular weight of 214.38 g/mol. Its IUPAC name is N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine.

Molecular Properties

Compound NameN-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine
PubChem CID43296815
Molecular FormulaC11H22N2S
Molecular Weight214.38 g/mol
Exact Mass214.15
IUPAC NameN-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine
SMILESCN(CC1CCCCN1)C1CCSC1
InChIInChI=1S/C11H22N2S/c1-13(11-5-7-14-9-11)8-10-4-2-3-6-12-10/h10-12H,2-9H2,1H3
InChIKeyMGAFKTCVJHEVQJ-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-amine
CID 131134698
N-methyl-N-(piperidin-2-ylmethyl)-4-propylcycloheptan-1-amine
CID 106623130
N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 106622935
2-ethyl-N,2-dimethyl-N-(piperidin-2-ylmethyl)oxan-4-amine
CID 106622844
4-tert-butyl-N-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106602645
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]oxolan-3-amine
CID 104870205
N-methyl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
CID 82739396
2-(thiolan-3-ylmethyl)pyrrolidine
CID 82653355
N-(piperidin-2-ylmethyl)thiolan-3-amine
CID 106634528
3-ethyl-N-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106602502
N,3,3-trimethyl-N-(pyrrolidin-2-ylmethyl)cyclopentan-1-amine
CID 106602628

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine?
The IUPAC name of N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine (CID 43296815) is N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine.
What is the SMILES notation for N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine?
The canonical SMILES for N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine is CN(CC1CCCCN1)C1CCSC1.
What is the InChIKey of N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine?
The InChIKey is MGAFKTCVJHEVQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2S/c1-13(11-5-7-14-9-11)8-10-4-2-3-6-12-10/h10-12H,2-9H2,1H3.
What are the key properties of N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine?
N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine has a molecular weight of 214.38 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine is sourced from PubChem (CID 43296815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).