(1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine

C11H23N3 — CID 83854378

IUPAC(1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine
SMILESCN1CC(CN)CC1C1CCCNC1
InChIInChI=1S/C11H23N3/c1-14-8-9(6-12)5-11(14)10-3-2-4-13-7-10/h9-11,13H,2-8,12H2,1H3
InChIKeyXNBFYONNVYLJJI-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.26
Rot. Bonds2

About (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine

(1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine (PubChem CID 83854378) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine.

Molecular Properties

Compound Name(1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine
PubChem CID83854378
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name(1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine
SMILESCN1CC(CN)CC1C1CCCNC1
InChIInChI=1S/C11H23N3/c1-14-8-9(6-12)5-11(14)10-3-2-4-13-7-10/h9-11,13H,2-8,12H2,1H3
InChIKeyXNBFYONNVYLJJI-UHFFFAOYSA-N
XLogP0.26
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

piperidin-3-ylmethanamine;trihydrochloride
CID 69122569
3-(1-methylpyrrolidin-3-yl)piperidine
CID 82413007
ethane;pyrrolidin-3-ylmethanamine
CID 142426131
(2S)-2-[(3R)-piperidin-3-yl]-1-propylpiperidine
CID 95241605
2-tert-butyl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-c]azepine
CID 126571223
(1S,7R)-2-methyl-2,11-diazabicyclo[5.5.0]dodecane
CID 96627763
3-[1-(3-methoxypropyl)pyrrolidin-2-yl]piperidine
CID 66273644
4-methyl-2-[(2-piperidin-3-ylpyrrolidin-1-yl)methyl]morpholine
CID 79182589
(3R)-3-(azetidin-3-yl)piperidine
CID 172571282
3-[1-(5-fluoropentyl)pyrrolidin-2-yl]piperidine
CID 114280388
(3aR,7aR)-1-methyl-2,3,3a,4,5,6,7,7a-octahydropyrrolo[3,2-c]pyridine
CID 82418150
1-methyl-6-(3-piperidin-3-ylpropyl)-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridine
CID 81200392

Frequently Asked Questions

What is the IUPAC name of (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine?
The IUPAC name of (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine (CID 83854378) is (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine.
What is the SMILES notation for (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine?
The canonical SMILES for (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine is CN1CC(CN)CC1C1CCCNC1.
What is the InChIKey of (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine?
The InChIKey is XNBFYONNVYLJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-14-8-9(6-12)5-11(14)10-3-2-4-13-7-10/h9-11,13H,2-8,12H2,1H3.
What are the key properties of (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine?
(1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine has a molecular weight of 197.33 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-5-piperidin-3-ylpyrrolidin-3-yl)methanamine is sourced from PubChem (CID 83854378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).