1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine

C14H23N3 — CID 82740318

IUPAC1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine
SMILESCCc1cccnc1CN1CCC(CNC)C1
InChIInChI=1S/C14H23N3/c1-3-13-5-4-7-16-14(13)11-17-8-6-12(10-17)9-15-2/h4-5,7,12,15H,3,6,8-11H2,1-2H3
InChIKeyVUZBYMCBXIFCNY-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.69
Rot. Bonds5

About 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine

1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine (PubChem CID 82740318) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine
PubChem CID82740318
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine
SMILESCCc1cccnc1CN1CCC(CNC)C1
InChIInChI=1S/C14H23N3/c1-3-13-5-4-7-16-14(13)11-17-8-6-12(10-17)9-15-2/h4-5,7,12,15H,3,6,8-11H2,1-2H3
InChIKeyVUZBYMCBXIFCNY-UHFFFAOYSA-N
XLogP1.69
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[(2-ethyl-6-fluorophenyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine;hydrochloride
CID 120838596
[2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-3-pyridinyl]methanamine
CID 114199079
3-[[3-(methylaminomethyl)piperidin-1-yl]methyl]pyridine-2-carbonitrile
CID 62894272
1-(1-benzylpyrrolidin-3-yl)-N-methylmethanamine
CID 4660832
1-[1-[(2,6-dimethylphenyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine
CID 81493001
2-chloro-3-[(3-ethylpyrrolidin-1-yl)methyl]pyridine
CID 115688607
N-methyl-1-[1-[(1-methylindol-3-yl)methyl]pyrrolidin-3-yl]methanamine
CID 63263270
6-methyl-2-[[3-(methylaminomethyl)pyrrolidin-1-yl]methyl]pyridin-3-ol
CID 79158948
N-methyl-1-[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methanamine
CID 81319065
N-methyl-1-[2-[(2-methylmorpholin-4-yl)methyl]-3-pyridinyl]methanamine
CID 114198961
1-[1-[(5-fluoroquinolin-8-yl)methyl]piperidin-4-yl]-N-methylmethanamine
CID 63249000
4-[(3-ethyl-2-pyridinyl)methyl]piperazine-2,6-dione
CID 82754494

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine (CID 82740318) is 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine is CCc1cccnc1CN1CCC(CNC)C1.
What is the InChIKey of 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine?
The InChIKey is VUZBYMCBXIFCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-13-5-4-7-16-14(13)11-17-8-6-12(10-17)9-15-2/h4-5,7,12,15H,3,6,8-11H2,1-2H3.
What are the key properties of 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine?
1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine has a molecular weight of 233.36 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(3-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 82740318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).