3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine

C12H21N3O — CID 102700670

IUPAC3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine
SMILESCCNCc1cccnc1NCC(C)OC
InChIInChI=1S/C12H21N3O/c1-4-13-9-11-6-5-7-14-12(11)15-8-10(2)16-3/h5-7,10,13H,4,8-9H2,1-3H3,(H,14,15)
InChIKeyQQUZDSPLLDDRPD-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.64
Rot. Bonds7

About 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine

3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine (PubChem CID 102700670) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine
PubChem CID102700670
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine
SMILESCCNCc1cccnc1NCC(C)OC
InChIInChI=1S/C12H21N3O/c1-4-13-9-11-6-5-7-14-12(11)15-8-10(2)16-3/h5-7,10,13H,4,8-9H2,1-3H3,(H,14,15)
InChIKeyQQUZDSPLLDDRPD-UHFFFAOYSA-N
XLogP1.64
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-propan-2-yloxy-3-pyridinyl)methyl]ethanamine
CID 61373670
[2-(ethylamino)-3-pyridinyl]methanol
CID 62464975
(2S)-1-[(2-methoxy-3-pyridinyl)methylamino]propan-2-ol
CID 106931879
3-(ethylaminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-2-amine
CID 82952630
6-N-ethyl-4-N-(2-methoxypropyl)-5-methylpyrimidine-4,6-diamine
CID 102701780
4-(ethylaminomethyl)-3-fluoro-N-(3-methyl-2-propan-2-ylbutyl)pyridin-2-amine
CID 102915247
N-[[2-(3,3-dimethylbutoxy)-3-pyridinyl]methyl]ethanamine
CID 66226371
1-[(3-iodo-2-pyridinyl)amino]propan-2-ol
CID 130724684
N-[2-[[3-(ethylaminomethyl)-2-pyridinyl]oxy]ethyl]-N-propan-2-ylpropan-2-amine
CID 115505728
3-(1-ethoxypropan-2-yloxymethyl)-N-ethylpyridin-2-amine
CID 103490226
(2S)-N-[(2-methoxy-3-pyridinyl)methyl]-2-methylbutan-1-amine
CID 93316989
N-(2-methoxypropyl)-4-[(propan-2-ylamino)methyl]isoquinolin-1-amine
CID 106777073

Frequently Asked Questions

What is the IUPAC name of 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine?
The IUPAC name of 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine (CID 102700670) is 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine.
What is the SMILES notation for 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine?
The canonical SMILES for 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine is CCNCc1cccnc1NCC(C)OC.
What is the InChIKey of 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine?
The InChIKey is QQUZDSPLLDDRPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-4-13-9-11-6-5-7-14-12(11)15-8-10(2)16-3/h5-7,10,13H,4,8-9H2,1-3H3,(H,14,15).
What are the key properties of 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine?
3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine has a molecular weight of 223.32 g/mol, XLogP of 1.64, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylaminomethyl)-N-(2-methoxypropyl)pyridin-2-amine is sourced from PubChem (CID 102700670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).