1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine

C12H18N2 — CID 43363176

IUPAC1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine
SMILESCC(NCc1ccccn1)C1(C)CC1
InChIInChI=1S/C12H18N2/c1-10(12(2)6-7-12)14-9-11-5-3-4-8-13-11/h3-5,8,10,14H,6-7,9H2,1-2H3
InChIKeyKWIYWXRXKFYRCH-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.36
Rot. Bonds4

About 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine

1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine (PubChem CID 43363176) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine
PubChem CID43363176
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine
SMILESCC(NCc1ccccn1)C1(C)CC1
InChIInChI=1S/C12H18N2/c1-10(12(2)6-7-12)14-9-11-5-3-4-8-13-11/h3-5,8,10,14H,6-7,9H2,1-2H3
InChIKeyKWIYWXRXKFYRCH-UHFFFAOYSA-N
XLogP2.36
TPSA24.92 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 ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-adamantyl)-N-(pyridin-2-ylmethyl)ethanamine;dihydrochloride
CID 163327971
(2S,3S)-3-methyl-N-(pyridin-2-ylmethyl)pentan-2-amine
CID 28618020
3-methyl-N-(pyridin-2-ylmethyl)pentan-2-amine
CID 43201494
1-(1-methylcyclopropyl)-N-[(5-methylpyrazin-2-yl)methyl]ethanamine
CID 62846796
(1S)-1-(1-methylcyclopropyl)-2-pyridin-2-ylethanamine
CID 135132633
1-ethylsulfonyl-N-(pyridin-2-ylmethyl)propan-2-amine
CID 115626100
(1S)-1-cycloheptyl-N-(pyridin-2-ylmethyl)ethanamine
CID 81391298
1-(2-methylpropyl)-2-(pyridin-2-ylmethyl)hydrazine;dihydrochloride
CID 71300115
1-(4-bromophenyl)-N-(pyridin-2-ylmethyl)ethanamine
CID 43178958
1-N-ethyl-1-N-methyl-2-N-(pyridin-2-ylmethyl)propane-1,2-diamine
CID 103109745
N-(pyridin-2-ylmethyl)hex-5-en-2-amine
CID 75525482
N-(pyridin-2-ylmethyl)octan-2-amine
CID 43085262

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine?
The IUPAC name of 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine (CID 43363176) is 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine.
What is the SMILES notation for 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine?
The canonical SMILES for 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine is CC(NCc1ccccn1)C1(C)CC1.
What is the InChIKey of 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine?
The InChIKey is KWIYWXRXKFYRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-10(12(2)6-7-12)14-9-11-5-3-4-8-13-11/h3-5,8,10,14H,6-7,9H2,1-2H3.
What are the key properties of 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine?
1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine has a molecular weight of 190.29 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopropyl)-N-(pyridin-2-ylmethyl)ethanamine is sourced from PubChem (CID 43363176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).