N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine

C12H18N2 — CID 105157241

IUPACN-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1cccnc1C)C1CC1
InChIInChI=1S/C12H18N2/c1-3-13-12(10-6-7-10)11-5-4-8-14-9(11)2/h4-5,8,10,12-13H,3,6-7H2,1-2H3
InChIKeyRNBLOOHXCOSPSC-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.45
Rot. Bonds4

About N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine

N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 105157241) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID105157241
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1cccnc1C)C1CC1
InChIInChI=1S/C12H18N2/c1-3-13-12(10-6-7-10)11-5-4-8-14-9(11)2/h4-5,8,10,12-13H,3,6-7H2,1-2H3
InChIKeyRNBLOOHXCOSPSC-UHFFFAOYSA-N
XLogP2.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3,5-dimethylcyclohexyl)-(2-methyl-3-pyridinyl)methyl]ethanamine
CID 105154308
[(4-ethylcyclohexyl)-(2-methyl-3-pyridinyl)methyl]hydrazine
CID 105313063
N-ethyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105082350
N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine
CID 64776463
N-ethyl-1-(2-methyl-3-pyridinyl)but-3-yn-1-amine
CID 105077584
N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
CID 105157145
N-[cyclopropyl(pyridin-3-yl)methyl]ethanamine
CID 60923514
N-[cyclopropyl(quinolin-4-yl)methyl]ethanamine
CID 105157242
N-[cycloheptyl(pyrimidin-2-yl)methyl]ethanamine
CID 82932188
N-[cyclobutyl-(2,3-dimethylphenyl)methyl]ethanamine
CID 64986462
N-[(4-methyl-3-pyridinyl)-(oxan-4-yl)methyl]ethanamine
CID 66272084
N-ethyl-2-(4-ethylphenyl)-1-(2-methyl-3-pyridinyl)ethanamine
CID 105101754

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine (CID 105157241) is N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine is CCNC(c1cccnc1C)C1CC1.
What is the InChIKey of N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is RNBLOOHXCOSPSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-3-13-12(10-6-7-10)11-5-4-8-14-9(11)2/h4-5,8,10,12-13H,3,6-7H2,1-2H3.
What are the key properties of N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine?
N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 190.29 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 105157241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).