1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine

C13H21N3 — CID 60857501

IUPAC1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine
SMILESCCN1CCC(CNCc2ccccn2)C1
InChIInChI=1S/C13H21N3/c1-2-16-8-6-12(11-16)9-14-10-13-5-3-4-7-15-13/h3-5,7,12,14H,2,6,8-11H2,1H3
InChIKeyMFEMORFQDAJUPX-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.51
Rot. Bonds5

About 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine

1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine (PubChem CID 60857501) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine
PubChem CID60857501
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine
SMILESCCN1CCC(CNCc2ccccn2)C1
InChIInChI=1S/C13H21N3/c1-2-16-8-6-12(11-16)9-14-10-13-5-3-4-7-15-13/h3-5,7,12,14H,2,6,8-11H2,1H3
InChIKeyMFEMORFQDAJUPX-UHFFFAOYSA-N
XLogP1.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-ethylpyrrolidin-3-yl)-N-[(2-methylpyrimidin-4-yl)methyl]methanamine
CID 55109731
1-[1-(4-chlorophenyl)pyrrolidin-3-yl]-N-(pyridin-2-ylmethyl)methanamine
CID 83468973
2-methyl-1-[(1-propylpyrrolidin-3-yl)methyl]-3-(pyridin-2-ylmethyl)guanidine
CID 110968006
2-[2-[[(1-ethylpyrrolidin-3-yl)methylamino]methyl]phenyl]acetic acid
CID 115461655
1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol
CID 110540631
6-[[(1-ethylpiperidin-4-yl)methylamino]methyl]pyridin-3-ol
CID 79783467
N-[[1-(2-pyridin-2-ylethyl)piperidin-3-yl]methyl]ethanamine
CID 63847232
2-(4-ethylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)ethanamine
CID 55024068
1-ethyl-N-(pyridin-2-ylmethyl)azepan-4-amine
CID 65072640
N-(1-benzofuran-3-ylmethyl)-1-(1-ethylpyrrolidin-3-yl)methanamine
CID 80701048
N-(pyridin-2-ylmethyl)-1-(thian-4-yl)methanamine
CID 115625870
N-[(5-ethylfuran-2-yl)methyl]-1-(1-ethylpyrrolidin-3-yl)methanamine
CID 62346349

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine?
The IUPAC name of 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine (CID 60857501) is 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine.
What is the SMILES notation for 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine?
The canonical SMILES for 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine is CCN1CCC(CNCc2ccccn2)C1.
What is the InChIKey of 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine?
The InChIKey is MFEMORFQDAJUPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-2-16-8-6-12(11-16)9-14-10-13-5-3-4-7-15-13/h3-5,7,12,14H,2,6,8-11H2,1H3.
What are the key properties of 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine?
1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine has a molecular weight of 219.33 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpyrrolidin-3-yl)-N-(pyridin-2-ylmethyl)methanamine is sourced from PubChem (CID 60857501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).