[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine

C12H19N3 — CID 115311630

IUPAC[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine
SMILESCc1ccc(CN2CCCC2CN)nc1
InChIInChI=1S/C12H19N3/c1-10-4-5-11(14-8-10)9-15-6-2-3-12(15)7-13/h4-5,8,12H,2-3,6-7,9,13H2,1H3
InChIKeyMSCYIZJHGUJHPO-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.31
Rot. Bonds3

About [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine

[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine (PubChem CID 115311630) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine
PubChem CID115311630
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine
SMILESCc1ccc(CN2CCCC2CN)nc1
InChIInChI=1S/C12H19N3/c1-10-4-5-11(14-8-10)9-15-6-2-3-12(15)7-13/h4-5,8,12H,2-3,6-7,9,13H2,1H3
InChIKeyMSCYIZJHGUJHPO-UHFFFAOYSA-N
XLogP1.31
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[1-[(5-methyl-2-pyridinyl)methyl]piperidin-2-yl]methanamine
CID 81318609
[1-[(2-methylpyrimidin-4-yl)methyl]pyrrolidin-2-yl]methanamine
CID 115527317
[1-[(5-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 81312464
2-[[2-(aminomethyl)pyrrolidin-1-yl]methyl]-7-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride
CID 119927110
6-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]pyridin-3-ol
CID 82980192
1-[1-[(5-bromo-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 104808848
[1-[(2,4,6-trimethylphenyl)methyl]pyrrolidin-2-yl]methanamine;hydrochloride
CID 119927229
[1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]methanamine
CID 115311784
[1-[(6-chloropyridazin-3-yl)methyl]piperidin-2-yl]methanamine
CID 71644496
6-[[2-(2-hydroxypropyl)pyrrolidin-1-yl]methyl]pyridine-3-carboxylic acid
CID 112748720
3-methyl-1-[(5-methyl-2-pyridinyl)methyl]pyrrolidine-2-carboxylic acid
CID 102786635
2-[(2S)-1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]-4,5,6,7-tetrahydro-1H-benzimidazole
CID 129338470

Frequently Asked Questions

What is the IUPAC name of [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine (CID 115311630) is [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine is Cc1ccc(CN2CCCC2CN)nc1.
What is the InChIKey of [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine?
The InChIKey is MSCYIZJHGUJHPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10-4-5-11(14-8-10)9-15-6-2-3-12(15)7-13/h4-5,8,12H,2-3,6-7,9,13H2,1H3.
What are the key properties of [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine?
[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine has a molecular weight of 205.31 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 115311630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).