1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine

C14H24N4 — CID 63169357

IUPAC1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCCNCc1ccnc(N2CCC(N(C)C)C2)c1
InChIInChI=1S/C14H24N4/c1-4-15-10-12-5-7-16-14(9-12)18-8-6-13(11-18)17(2)3/h5,7,9,13,15H,4,6,8,10-11H2,1-3H3
InChIKeySMQQSEPGUPDCOJ-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.33
Rot. Bonds5

About 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine

1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine (PubChem CID 63169357) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
PubChem CID63169357
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCCNCc1ccnc(N2CCC(N(C)C)C2)c1
InChIInChI=1S/C14H24N4/c1-4-15-10-12-5-7-16-14(9-12)18-8-6-13(11-18)17(2)3/h5,7,9,13,15H,4,6,8,10-11H2,1-3H3
InChIKeySMQQSEPGUPDCOJ-UHFFFAOYSA-N
XLogP1.33
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine (CID 63169357) is 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine is CCNCc1ccnc(N2CCC(N(C)C)C2)c1.
What is the InChIKey of 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
The InChIKey is SMQQSEPGUPDCOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-4-15-10-12-5-7-16-14(9-12)18-8-6-13(11-18)17(2)3/h5,7,9,13,15H,4,6,8,10-11H2,1-3H3.
What are the key properties of 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine has a molecular weight of 248.37 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(ethylaminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 63169357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).