2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine

C12H18N2 — CID 64906307

IUPAC2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine
SMILESCCNC(CC1CC1)c1ccncc1
InChIInChI=1S/C12H18N2/c1-2-14-12(9-10-3-4-10)11-5-7-13-8-6-11/h5-8,10,12,14H,2-4,9H2,1H3
InChIKeyBHQYDFISTQTXMX-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.53
Rot. Bonds5

About 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine

2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine (PubChem CID 64906307) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine.

Molecular Properties

Compound Name2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine
PubChem CID64906307
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine
SMILESCCNC(CC1CC1)c1ccncc1
InChIInChI=1S/C12H18N2/c1-2-14-12(9-10-3-4-10)11-5-7-13-8-6-11/h5-8,10,12,14H,2-4,9H2,1H3
InChIKeyBHQYDFISTQTXMX-UHFFFAOYSA-N
XLogP2.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine?
The IUPAC name of 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine (CID 64906307) is 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine.
What is the SMILES notation for 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine?
The canonical SMILES for 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine is CCNC(CC1CC1)c1ccncc1.
What is the InChIKey of 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine?
The InChIKey is BHQYDFISTQTXMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-2-14-12(9-10-3-4-10)11-5-7-13-8-6-11/h5-8,10,12,14H,2-4,9H2,1H3.
What are the key properties of 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine?
2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine has a molecular weight of 190.29 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-ethyl-1-pyridin-4-ylethanamine is sourced from PubChem (CID 64906307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).