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

C13H21N3 — CID 62592710

IUPACN-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine
SMILESCCNCC1CCCN1c1ncccc1C
InChIInChI=1S/C13H21N3/c1-3-14-10-12-7-5-9-16(12)13-11(2)6-4-8-15-13/h4,6,8,12,14H,3,5,7,9-10H2,1-2H3
InChIKeyXGUFPJGOEULMQG-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.97
Rot. Bonds4

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

N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine (PubChem CID 62592710) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine
PubChem CID62592710
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC NameN-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine
SMILESCCNCC1CCCN1c1ncccc1C
InChIInChI=1S/C13H21N3/c1-3-14-10-12-7-5-9-16(12)13-11(2)6-4-8-15-13/h4,6,8,12,14H,3,5,7,9-10H2,1-2H3
InChIKeyXGUFPJGOEULMQG-UHFFFAOYSA-N
XLogP1.97
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]propan-1-amine
CID 62593221
N-[[1-(5-chloropyrimidin-4-yl)pyrrolidin-2-yl]methyl]ethanamine
CID 105370506
N-[[1-(5-bromopyrimidin-2-yl)pyrrolidin-2-yl]methyl]ethanamine
CID 63873612
N-[(1-quinoxalin-2-ylpyrrolidin-2-yl)methyl]ethanamine
CID 55090959
3-bromo-2-(2-ethylpyrrolidin-1-yl)-4-methylpyridine
CID 106876417
N-[[1-(3-fluoro-2-pyridinyl)pyrrolidin-2-yl]methyl]cyclopropanamine
CID 62734377
N-[[1-(5-methyl-2-pyridinyl)piperidin-2-yl]methyl]ethanamine
CID 62593584
[2-(2-ethylpyrrolidin-1-yl)-3-pyridinyl]methanol
CID 61254159
5-bromo-4-[2-(ethylaminomethyl)pyrrolidin-1-yl]-1H-pyrimidin-6-one
CID 136989741
5-amino-4-[2-(ethylaminomethyl)pyrrolidin-1-yl]-1H-pyrimidin-6-one
CID 137007904
2-methyl-N-[[1-(3-methylsulfonyl-2-pyridinyl)pyrrolidin-2-yl]methyl]propan-2-amine
CID 114599572
N-[[6-(2-ethylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]methyl]ethanamine
CID 80630583

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine?
The IUPAC name of N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine (CID 62592710) is N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine is CCNCC1CCCN1c1ncccc1C.
What is the InChIKey of N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine?
The InChIKey is XGUFPJGOEULMQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-3-14-10-12-7-5-9-16(12)13-11(2)6-4-8-15-13/h4,6,8,12,14H,3,5,7,9-10H2,1-2H3.
What are the key properties of N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine?
N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine has a molecular weight of 219.33 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-methyl-2-pyridinyl)pyrrolidin-2-yl]methyl]ethanamine is sourced from PubChem (CID 62592710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).