1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine

C13H20N2 — CID 83908685

IUPAC1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine
SMILESCCC(CC1(N)CC1)c1ccc(C)nc1
InChIInChI=1S/C13H20N2/c1-3-11(8-13(14)6-7-13)12-5-4-10(2)15-9-12/h4-5,9,11H,3,6-8,14H2,1-2H3
InChIKeyOFHQBZCCFJOTGJ-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.77
Rot. Bonds4

About 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine

1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine (PubChem CID 83908685) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine
PubChem CID83908685
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine
SMILESCCC(CC1(N)CC1)c1ccc(C)nc1
InChIInChI=1S/C13H20N2/c1-3-11(8-13(14)6-7-13)12-5-4-10(2)15-9-12/h4-5,9,11H,3,6-8,14H2,1-2H3
InChIKeyOFHQBZCCFJOTGJ-UHFFFAOYSA-N
XLogP2.77
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-decan-5-yl-2-methylpyridine
CID 91157636
1-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-diethylcyclopentan-1-amine
CID 79070030
2-(6-methyl-3-pyridinyl)propan-1-amine
CID 81021181
1-(6-methyl-3-pyridinyl)-3-sulfanylpropane-1,2-diol
CID 170819362
1-(1-ethylcyclopentyl)-N-methyl-1-(6-methyl-3-pyridinyl)methanamine
CID 115854871
2-chloro-5-pentan-3-ylpyridine
CID 134459618
(6-methyl-3-pyridinyl)-(4-propan-2-ylphenyl)methanamine
CID 55164666
2-ethyl-N-methyl-1-(6-methyl-3-pyridinyl)butan-1-amine
CID 115854887
ethane;(1S)-N-ethyl-1-(6-methyl-3-pyridinyl)propan-1-amine
CID 143971638
3-ethyl-1-(6-methyl-3-pyridinyl)pentan-1-ol
CID 104823060
N,N-diethyl-1-[hydrazinyl-(6-methyl-3-pyridinyl)methyl]cyclopentan-1-amine
CID 105242677
2-(azocan-1-yl)-2-(6-methyl-3-pyridinyl)ethanamine
CID 113457077

Frequently Asked Questions

What is the IUPAC name of 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine (CID 83908685) is 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine is CCC(CC1(N)CC1)c1ccc(C)nc1.
What is the InChIKey of 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine?
The InChIKey is OFHQBZCCFJOTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-3-11(8-13(14)6-7-13)12-5-4-10(2)15-9-12/h4-5,9,11H,3,6-8,14H2,1-2H3.
What are the key properties of 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine?
1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine has a molecular weight of 204.32 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6-methyl-3-pyridinyl)butyl]cyclopropan-1-amine is sourced from PubChem (CID 83908685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).