[6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine

C14H23N3 — CID 83221720

IUPAC[6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine
SMILESCCC1CCC(C)N1Cc1ccc(CN)cn1
InChIInChI=1S/C14H23N3/c1-3-14-7-4-11(2)17(14)10-13-6-5-12(8-15)9-16-13/h5-6,9,11,14H,3-4,7-8,10,15H2,1-2H3
InChIKeyUVXZZROVZVWHAX-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.30
Rot. Bonds4

About [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine

[6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine (PubChem CID 83221720) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine
PubChem CID83221720
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name[6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine
SMILESCCC1CCC(C)N1Cc1ccc(CN)cn1
InChIInChI=1S/C14H23N3/c1-3-14-7-4-11(2)17(14)10-13-6-5-12(8-15)9-16-13/h5-6,9,11,14H,3-4,7-8,10,15H2,1-2H3
InChIKeyUVXZZROVZVWHAX-UHFFFAOYSA-N
XLogP2.30
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine?
The IUPAC name of [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine (CID 83221720) is [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine.
What is the SMILES notation for [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine?
The canonical SMILES for [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine is CCC1CCC(C)N1Cc1ccc(CN)cn1.
What is the InChIKey of [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine?
The InChIKey is UVXZZROVZVWHAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-14-7-4-11(2)17(14)10-13-6-5-12(8-15)9-16-13/h5-6,9,11,14H,3-4,7-8,10,15H2,1-2H3.
What are the key properties of [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine?
[6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine has a molecular weight of 233.36 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]methanamine is sourced from PubChem (CID 83221720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).