3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine

C14H25N3O2 — CID 82952880

IUPAC3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine
SMILESCCOCCN(CCOCC)c1ccncc1CN
InChIInChI=1S/C14H25N3O2/c1-3-18-9-7-17(8-10-19-4-2)14-5-6-16-12-13(14)11-15/h5-6,12H,3-4,7-11,15H2,1-2H3
InChIKeyQVKWOEBRQCPNJI-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.42
Rot. Bonds10

About 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine

3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine (PubChem CID 82952880) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine
PubChem CID82952880
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine
SMILESCCOCCN(CCOCC)c1ccncc1CN
InChIInChI=1S/C14H25N3O2/c1-3-18-9-7-17(8-10-19-4-2)14-5-6-16-12-13(14)11-15/h5-6,12H,3-4,7-11,15H2,1-2H3
InChIKeyQVKWOEBRQCPNJI-UHFFFAOYSA-N
XLogP1.42
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine
CID 81248237
5-(aminomethyl)-N,N-bis(2-ethoxyethyl)-2-methylpyridin-4-amine
CID 82952312
[4-[2-ethoxyethyl(methyl)amino]-3-pyridinyl]methanol
CID 81237193
3-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
CID 81248637
3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
CID 81249725
3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine
CID 81247312
3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine
CID 81248963
3-(aminomethyl)-N-methyl-N-pentylpyridin-4-amine
CID 81248532
4-(aminomethyl)-N,N-bis(2-ethoxyethyl)-3-fluoropyridin-2-amine
CID 105390289
N-(2-ethoxyethyl)-N-methyl-3-(propylaminomethyl)pyridin-4-amine
CID 81247682
5-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-2-amine
CID 82961058
3-(aminomethyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-4-amine
CID 81246543

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine (CID 82952880) is 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine is CCOCCN(CCOCC)c1ccncc1CN.
What is the InChIKey of 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine?
The InChIKey is QVKWOEBRQCPNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-3-18-9-7-17(8-10-19-4-2)14-5-6-16-12-13(14)11-15/h5-6,12H,3-4,7-11,15H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine?
3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine has a molecular weight of 267.37 g/mol, XLogP of 1.42, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine is sourced from PubChem (CID 82952880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).