N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine

C13H20N2 — CID 115916461

IUPACN-(1-cyclopropylbutyl)-3-methylpyridin-2-amine
SMILESCCCC(Nc1ncccc1C)C1CC1
InChIInChI=1S/C13H20N2/c1-3-5-12(11-7-8-11)15-13-10(2)6-4-9-14-13/h4,6,9,11-12H,3,5,7-8H2,1-2H3,(H,14,15)
InChIKeyURAJHDXCUNBPJY-UHFFFAOYSA-N
MW204.32 g/mol
LogP3.38
Rot. Bonds5

About N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine

N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine (PubChem CID 115916461) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(1-cyclopropylbutyl)-3-methylpyridin-2-amine
PubChem CID115916461
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-(1-cyclopropylbutyl)-3-methylpyridin-2-amine
SMILESCCCC(Nc1ncccc1C)C1CC1
InChIInChI=1S/C13H20N2/c1-3-5-12(11-7-8-11)15-13-10(2)6-4-9-14-13/h4,6,9,11-12H,3,5,7-8H2,1-2H3,(H,14,15)
InChIKeyURAJHDXCUNBPJY-UHFFFAOYSA-N
XLogP3.38
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopropylbutyl)-3-ethylpyridin-2-amine
CID 115929561
N-(dicyclopropylmethyl)-3-methylpyridin-2-amine
CID 62253161
3-methyl-N-(1-phenylpentyl)pyridin-2-amine
CID 134824082
2-[(3-methyl-2-pyridinyl)amino]propane-1,3-diol
CID 65314837
N-(1-cyclopropylpropyl)-8-methylquinolin-5-amine
CID 64920537
3-methyl-N-[1-(4-methylphenyl)heptyl]pyridin-2-amine
CID 86203051
N-(1-cyclohexylpropyl)-3-methoxypyridin-2-amine
CID 113370900
(2R)-2-amino-N-(3-methyl-2-pyridinyl)pentanamide
CID 107568105
N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 62252990
1-cyclooctyl-N-ethyl-2-(3-methyl-2-pyridinyl)ethanamine
CID 66447669
ethyl 2-[(2-amino-1-cyclopentylethyl)amino]pyridine-3-carboxylate
CID 106738180
3-methyl-N-(3-methylbutyl)pyridin-2-amine
CID 60960877

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine?
The IUPAC name of N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine (CID 115916461) is N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine.
What is the SMILES notation for N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine?
The canonical SMILES for N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine is CCCC(Nc1ncccc1C)C1CC1.
What is the InChIKey of N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine?
The InChIKey is URAJHDXCUNBPJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-3-5-12(11-7-8-11)15-13-10(2)6-4-9-14-13/h4,6,9,11-12H,3,5,7-8H2,1-2H3,(H,14,15).
What are the key properties of N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine?
N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine has a molecular weight of 204.32 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylbutyl)-3-methylpyridin-2-amine is sourced from PubChem (CID 115916461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).