(1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine

C11H16N2 — CID 135132633

IUPAC(1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine
SMILESCC1([C@@H](N)Cc2ccccn2)CC1
InChIInChI=1S/C11H16N2/c1-11(5-6-11)10(12)8-9-4-2-3-7-13-9/h2-4,7,10H,5-6,8,12H2,1H3/t10-/m0/s1
InChIKeyDFJOIGNMDZXDFS-JTQLQIEISA-N
MW176.26 g/mol
LogP1.75
Rot. Bonds3

About (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine

(1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine (PubChem CID 135132633) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine.

Molecular Properties

Compound Name(1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine
PubChem CID135132633
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name(1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine
SMILESCC1([C@@H](N)Cc2ccccn2)CC1
InChIInChI=1S/C11H16N2/c1-11(5-6-11)10(12)8-9-4-2-3-7-13-9/h2-4,7,10H,5-6,8,12H2,1H3/t10-/m0/s1
InChIKeyDFJOIGNMDZXDFS-JTQLQIEISA-N
XLogP1.75
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-methyl-2-phenyl-1,3-dioxan-5-yl)-2-pyridin-2-ylethanamine
CID 175136635
(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
1-(1-amino-2-pyridin-2-ylethyl)-N,N,4-trimethylcyclohexan-1-amine
CID 79074427
1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine
CID 43363176
2-(5-bromo-2-pyridinyl)-1-(1-methylcyclopentyl)ethanamine
CID 105036053
3-amino-4-pyridin-2-ylbutan-2-one
CID 58265029
2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclohexyl)ethanamine
CID 106830386
4-methyl-1-pyridin-2-ylpentan-2-amine
CID 43118867
(2S)-2-amino-3-pyridin-2-ylpropanoic acid;hydrochloride
CID 46705394
3-phenyl-1-pyridin-2-ylpentan-2-amine
CID 104995303
3-cyclopropyl-1-pyridin-2-ylbutan-2-amine
CID 83155129
1-(pyridin-2-ylmethyl)cyclopropan-1-amine
CID 59327087

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine?
The IUPAC name of (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine (CID 135132633) is (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine.
What is the SMILES notation for (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine?
The canonical SMILES for (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine is CC1([C@@H](N)Cc2ccccn2)CC1.
What is the InChIKey of (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine?
The InChIKey is DFJOIGNMDZXDFS-JTQLQIEISA-N. The full InChI is InChI=1S/C11H16N2/c1-11(5-6-11)10(12)8-9-4-2-3-7-13-9/h2-4,7,10H,5-6,8,12H2,1H3/t10-/m0/s1.
What are the key properties of (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine?
(1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine has a molecular weight of 176.26 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine is sourced from PubChem (CID 135132633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).