N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine

C14H20N4 — CID 83127825

IUPACN-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine
SMILESCCCc1nccn1-c1ccc(C(C)NC)nc1
InChIInChI=1S/C14H20N4/c1-4-5-14-16-8-9-18(14)12-6-7-13(17-10-12)11(2)15-3/h6-11,15H,4-5H2,1-3H3
InChIKeyKNUBBDBNVPZQDN-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.50
Rot. Bonds5

About N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine

N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine (PubChem CID 83127825) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine
PubChem CID83127825
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC NameN-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine
SMILESCCCc1nccn1-c1ccc(C(C)NC)nc1
InChIInChI=1S/C14H20N4/c1-4-5-14-16-8-9-18(14)12-6-7-13(17-10-12)11(2)15-3/h6-11,15H,4-5H2,1-3H3
InChIKeyKNUBBDBNVPZQDN-UHFFFAOYSA-N
XLogP2.50
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine?
The IUPAC name of N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine (CID 83127825) is N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine.
What is the SMILES notation for N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine?
The canonical SMILES for N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine is CCCc1nccn1-c1ccc(C(C)NC)nc1.
What is the InChIKey of N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine?
The InChIKey is KNUBBDBNVPZQDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-4-5-14-16-8-9-18(14)12-6-7-13(17-10-12)11(2)15-3/h6-11,15H,4-5H2,1-3H3.
What are the key properties of N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine?
N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine has a molecular weight of 244.34 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(2-propylimidazol-1-yl)-2-pyridinyl]ethanamine is sourced from PubChem (CID 83127825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).