3-cyclopropyl-1-pyridin-2-ylbutan-2-amine

C12H18N2 — CID 83155129

IUPAC3-cyclopropyl-1-pyridin-2-ylbutan-2-amine
SMILESCC(C(N)Cc1ccccn1)C1CC1
InChIInChI=1S/C12H18N2/c1-9(10-5-6-10)12(13)8-11-4-2-3-7-14-11/h2-4,7,9-10,12H,5-6,8,13H2,1H3
InChIKeySPRYOSCKHMZZLK-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.00
Rot. Bonds4

About 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine

3-cyclopropyl-1-pyridin-2-ylbutan-2-amine (PubChem CID 83155129) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine.

Molecular Properties

Compound Name3-cyclopropyl-1-pyridin-2-ylbutan-2-amine
PubChem CID83155129
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-cyclopropyl-1-pyridin-2-ylbutan-2-amine
SMILESCC(C(N)Cc1ccccn1)C1CC1
InChIInChI=1S/C12H18N2/c1-9(10-5-6-10)12(13)8-11-4-2-3-7-14-11/h2-4,7,9-10,12H,5-6,8,13H2,1H3
InChIKeySPRYOSCKHMZZLK-UHFFFAOYSA-N
XLogP2.00
TPSA38.91 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 ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-3-cyclopropylbutyl)pyridine
CID 83152951
2-(2-cyclopropyl-3-methylbutyl)pyridine
CID 54206046
1-cyclopropyl-N-methyl-2-pyridin-2-ylethanamine
CID 63352689
(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
1-(4-tert-butylcyclohexyl)-2-pyridin-2-ylethanamine
CID 62718393
2-(1-cyclopropylethoxymethyl)pyridine
CID 88973388
1-cyclohexyl-N-methyl-2-pyridin-2-ylethanamine
CID 60819908
[1-(4-methylcyclohexyl)-2-pyridin-2-ylethyl]hydrazine
CID 105199922
4-methyl-1-pyridin-2-ylpentan-2-amine
CID 43118867
1-(1-amino-2-pyridin-2-ylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 79074427
3-phenyl-1-pyridin-2-ylpentan-2-amine
CID 104995303
1-cyclohexyl-3-pyridin-2-ylbutan-2-amine
CID 66448950

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine?
The IUPAC name of 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine (CID 83155129) is 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine.
What is the SMILES notation for 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine?
The canonical SMILES for 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine is CC(C(N)Cc1ccccn1)C1CC1.
What is the InChIKey of 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine?
The InChIKey is SPRYOSCKHMZZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9(10-5-6-10)12(13)8-11-4-2-3-7-14-11/h2-4,7,9-10,12H,5-6,8,13H2,1H3.
What are the key properties of 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine?
3-cyclopropyl-1-pyridin-2-ylbutan-2-amine has a molecular weight of 190.29 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-pyridin-2-ylbutan-2-amine is sourced from PubChem (CID 83155129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).