2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine

C13H23N3O2 — CID 62284664

IUPAC2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine
SMILESCOCCCN(CCOC)c1ccnc(CN)c1
InChIInChI=1S/C13H23N3O2/c1-17-8-3-6-16(7-9-18-2)13-4-5-15-12(10-13)11-14/h4-5,10H,3,6-9,11,14H2,1-2H3
InChIKeySVAUCJZVQPJRHF-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.03
Rot. Bonds9

About 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine

2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine (PubChem CID 62284664) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine
PubChem CID62284664
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine
SMILESCOCCCN(CCOC)c1ccnc(CN)c1
InChIInChI=1S/C13H23N3O2/c1-17-8-3-6-16(7-9-18-2)13-4-5-15-12(10-13)11-14/h4-5,10H,3,6-9,11,14H2,1-2H3
InChIKeySVAUCJZVQPJRHF-UHFFFAOYSA-N
XLogP1.03
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.03
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

2-(aminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 62285332
2-(aminomethyl)-N,N-dibutylpyridin-4-amine
CID 62300849
4-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyrimidin-2-amine
CID 107541800
2-(aminomethyl)-N-(2-ethoxyethyl)-N-ethylpyridin-4-amine
CID 63697340
4-(aminomethyl)-3-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)aniline
CID 55152229
6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine
CID 62284666
2-methoxy-4-N-(2-methoxyethyl)-4-N-(3-methoxypropyl)benzene-1,4-diamine
CID 63675678
2-[2-methoxyethyl(3-methoxypropyl)amino]pyridine-4-carbothioamide
CID 54990055
2-(aminomethyl)-N,N-bis(2-methoxyethyl)pyridine-4-carboxamide
CID 114325701
[2-[2-methoxyethyl(3-methoxypropyl)amino]-4-pyridinyl]methanol
CID 54989948
[4-(2-methoxyethoxy)-2-pyridinyl]methanamine
CID 62292533
N'-[2-(aminomethyl)-4-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63695632

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine?
The IUPAC name of 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine (CID 62284664) is 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine.
What is the SMILES notation for 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine?
The canonical SMILES for 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine is COCCCN(CCOC)c1ccnc(CN)c1.
What is the InChIKey of 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine?
The InChIKey is SVAUCJZVQPJRHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-17-8-3-6-16(7-9-18-2)13-4-5-15-12(10-13)11-14/h4-5,10H,3,6-9,11,14H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine?
2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine has a molecular weight of 253.35 g/mol, XLogP of 1.03, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine is sourced from PubChem (CID 62284664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).