2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine

C15H22N2 — CID 102880910

IUPAC2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
SMILESCc1cncc(CNCC(C2CC2)C2CC2)c1
InChIInChI=1S/C15H22N2/c1-11-6-12(8-16-7-11)9-17-10-15(13-2-3-13)14-4-5-14/h6-8,13-15,17H,2-5,9-10H2,1H3
InChIKeyXQTMJQCBOQQWEI-UHFFFAOYSA-N
MW230.35 g/mol
LogP2.92
Rot. Bonds6

About 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine

2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 102880910) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID102880910
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
SMILESCc1cncc(CNCC(C2CC2)C2CC2)c1
InChIInChI=1S/C15H22N2/c1-11-6-12(8-16-7-11)9-17-10-15(13-2-3-13)14-4-5-14/h6-8,13-15,17H,2-5,9-10H2,1H3
InChIKeyXQTMJQCBOQQWEI-UHFFFAOYSA-N
XLogP2.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880981
(1S)-1-cyclohexyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880979
N-[(5-methyl-3-pyridinyl)methyl]thian-4-amine
CID 103864382
N-[(5-methyl-3-pyridinyl)methyl]-1-(thiolan-3-yl)methanamine
CID 107166716
1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine
CID 130908640
1-(2-methylcyclopentyl)-N-[(5-methyl-3-pyridinyl)methyl]methanamine
CID 107418287
2-(2-chloroethyl)-N-[(5-methyl-3-pyridinyl)methyl]pentan-1-amine
CID 106117164
N'-[(5-methyl-3-pyridinyl)methyl]ethane-1,2-diamine
CID 21271666
methyl 2-bromo-3-[(5-methyl-3-pyridinyl)methylamino]propanoate
CID 103492308
1-(2-chlorocyclopentyl)-N-[(5-methyl-3-pyridinyl)methyl]methanamine
CID 102878907
2-cyclopentyloxy-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880866
N-[(5-methyl-3-pyridinyl)methyl]formamide
CID 142430826

Frequently Asked Questions

What is the IUPAC name of 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine (CID 102880910) is 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine is Cc1cncc(CNCC(C2CC2)C2CC2)c1.
What is the InChIKey of 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is XQTMJQCBOQQWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-11-6-12(8-16-7-11)9-17-10-15(13-2-3-13)14-4-5-14/h6-8,13-15,17H,2-5,9-10H2,1H3.
What are the key properties of 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 230.35 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 102880910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).