N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine

C14H23N3 — CID 83074255

IUPACN-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine
SMILESCCC1(CN(C)Cc2ccccn2)CCCN1
InChIInChI=1S/C14H23N3/c1-3-14(8-6-10-16-14)12-17(2)11-13-7-4-5-9-15-13/h4-5,7,9,16H,3,6,8,10-12H2,1-2H3
InChIKeyQQDHYOGUYWEPSY-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.05
Rot. Bonds5

About N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine

N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine (PubChem CID 83074255) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine.

Molecular Properties

Compound NameN-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine
PubChem CID83074255
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine
SMILESCCC1(CN(C)Cc2ccccn2)CCCN1
InChIInChI=1S/C14H23N3/c1-3-14(8-6-10-16-14)12-17(2)11-13-7-4-5-9-15-13/h4-5,7,9,16H,3,6,8,10-12H2,1-2H3
InChIKeyQQDHYOGUYWEPSY-UHFFFAOYSA-N
XLogP2.05
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 ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine?
The IUPAC name of N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine (CID 83074255) is N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine.
What is the SMILES notation for N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine?
The canonical SMILES for N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine is CCC1(CN(C)Cc2ccccn2)CCCN1.
What is the InChIKey of N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine?
The InChIKey is QQDHYOGUYWEPSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-14(8-6-10-16-14)12-17(2)11-13-7-4-5-9-15-13/h4-5,7,9,16H,3,6,8,10-12H2,1-2H3.
What are the key properties of N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine?
N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine has a molecular weight of 233.36 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine is sourced from PubChem (CID 83074255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).