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

C12H18N2 — CID 63305633

IUPAC1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine
SMILESCc1cccnc1CNC(C)C1CC1
InChIInChI=1S/C12H18N2/c1-9-4-3-7-13-12(9)8-14-10(2)11-5-6-11/h3-4,7,10-11,14H,5-6,8H2,1-2H3
InChIKeyKOEZHROIJGCUBU-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.28
Rot. Bonds4

About 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine

1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine (PubChem CID 63305633) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine
PubChem CID63305633
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine
SMILESCc1cccnc1CNC(C)C1CC1
InChIInChI=1S/C12H18N2/c1-9-4-3-7-13-12(9)8-14-10(2)11-5-6-11/h3-4,7,10-11,14H,5-6,8H2,1-2H3
InChIKeyKOEZHROIJGCUBU-UHFFFAOYSA-N
XLogP2.28
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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dicyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine
CID 112650218
3-methyl-2-[(3-methyl-2-pyridinyl)methylamino]butan-1-ol
CID 112650240
2-[[[(1S)-1-cyclohexylethyl]amino]methyl]pyridine-3-carboxylic acid
CID 114198751
N-[(3-methyl-2-pyridinyl)methyl]cyclobutanamine
CID 63305574
2-methyl-3-[(3-methyl-2-pyridinyl)methylamino]butan-2-ol
CID 65337637
(1S)-N-[(3-methyl-2-pyridinyl)methyl]-1-pyridin-4-ylethanamine
CID 103954568
(1S)-1-(4-methylphenyl)-N-[(3-methyl-2-pyridinyl)methyl]ethanamine
CID 103954544
N-[(3-methyl-2-pyridinyl)methyl]-1-(5-methylthiophen-2-yl)propan-2-amine
CID 112650189
1-(oxolan-3-yl)-N-[[3-(trifluoromethyl)-2-pyridinyl]methyl]ethanamine
CID 75483307
N-carbamoyl-2-[(3-methyl-2-pyridinyl)methylamino]propanamide
CID 63306295
methyl 2-[(3-methyl-2-pyridinyl)methylamino]propanoate
CID 63305760
N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-2-ylethanamine
CID 63306075

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine (CID 63305633) is 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine is Cc1cccnc1CNC(C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine?
The InChIKey is KOEZHROIJGCUBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-4-3-7-13-12(9)8-14-10(2)11-5-6-11/h3-4,7,10-11,14H,5-6,8H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine?
1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine has a molecular weight of 190.29 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(3-methyl-2-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 63305633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).