5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine

C13H21N3O — CID 62182826

IUPAC5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine
SMILESCCN(Cc1ccc(N)nc1)CC1CCCO1
InChIInChI=1S/C13H21N3O/c1-2-16(10-12-4-3-7-17-12)9-11-5-6-13(14)15-8-11/h5-6,8,12H,2-4,7,9-10H2,1H3,(H2,14,15)
InChIKeyIUYQDDJVQKVZFR-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.66
Rot. Bonds5

About 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine

5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine (PubChem CID 62182826) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine
PubChem CID62182826
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine
SMILESCCN(Cc1ccc(N)nc1)CC1CCCO1
InChIInChI=1S/C13H21N3O/c1-2-16(10-12-4-3-7-17-12)9-11-5-6-13(14)15-8-11/h5-6,8,12H,2-4,7,9-10H2,1H3,(H2,14,15)
InChIKeyIUYQDDJVQKVZFR-UHFFFAOYSA-N
XLogP1.66
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[ethyl(oxolan-2-ylmethyl)amino]methyl]aniline
CID 43458835
4-[[ethyl(oxan-2-ylmethyl)amino]methyl]aniline
CID 43591939
5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]-2-methoxyaniline
CID 61433743
5-[[(4-methoxyphenyl)methyl-(oxolan-2-ylmethyl)amino]methyl]pyrimidin-2-amine
CID 46962866
6-amino-N-ethyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 62161209
N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine
CID 144767444
N-[[5-(aminomethyl)furan-2-yl]methyl]-N-(oxolan-2-ylmethyl)ethanamine
CID 62431237
N-[(3-bromophenyl)methyl]-N-(oxolan-2-ylmethyl)ethanamine
CID 47646761
2-[[ethyl(oxolan-2-ylmethyl)amino]methyl]-4-fluoroaniline
CID 61433507
N-[[2-(aminomethyl)-3-pyridinyl]methyl]-N-(oxolan-2-ylmethyl)ethanamine
CID 62894833
5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]-2-fluorobenzenecarbothioamide
CID 107879246
N-[(4-methoxyphenyl)methyl]-N-[[2-(4-methoxyphenyl)pyrimidin-5-yl]methyl]-1-[(2R)-oxolan-2-yl]methanamine
CID 92595723

Frequently Asked Questions

What is the IUPAC name of 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine?
The IUPAC name of 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine (CID 62182826) is 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine.
What is the SMILES notation for 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine?
The canonical SMILES for 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine is CCN(Cc1ccc(N)nc1)CC1CCCO1.
What is the InChIKey of 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine?
The InChIKey is IUYQDDJVQKVZFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-2-16(10-12-4-3-7-17-12)9-11-5-6-13(14)15-8-11/h5-6,8,12H,2-4,7,9-10H2,1H3,(H2,14,15).
What are the key properties of 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine?
5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-2-amine is sourced from PubChem (CID 62182826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).