6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine

C15H28N4 — CID 62294532

IUPAC6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine
SMILESCCCCCN(c1ccc(CNCC)nn1)C(C)C
InChIInChI=1S/C15H28N4/c1-5-7-8-11-19(13(3)4)15-10-9-14(17-18-15)12-16-6-2/h9-10,13,16H,5-8,11-12H2,1-4H3
InChIKeyBHGVSRVWJVIJQP-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.99
Rot. Bonds9

About 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine

6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine (PubChem CID 62294532) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine
PubChem CID62294532
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine
SMILESCCCCCN(c1ccc(CNCC)nn1)C(C)C
InChIInChI=1S/C15H28N4/c1-5-7-8-11-19(13(3)4)15-10-9-14(17-18-15)12-16-6-2/h9-10,13,16H,5-8,11-12H2,1-4H3
InChIKeyBHGVSRVWJVIJQP-UHFFFAOYSA-N
XLogP2.99
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-6-(ethylaminomethyl)-N-propan-2-ylpyridazin-3-amine
CID 62280228
6-(aminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine
CID 62286551
6-[(cyclopropylamino)methyl]-N-pentyl-N-propan-2-ylpyridazin-3-amine
CID 62294875
6-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 62282477
N-(2-methoxyethyl)-N-propan-2-yl-6-(propylaminomethyl)pyridazin-3-amine
CID 82953348
[6-[propan-2-yl(propyl)amino]pyridazin-3-yl]methanol
CID 61257071
N,N-diethyl-6-(ethylaminomethyl)pyridazin-3-amine
CID 62286106
6-(ethylaminomethyl)-N-(2-methoxyethyl)-N-pentan-3-ylpyridazin-3-amine
CID 62289229
5-(bromomethyl)-N-pentyl-N-propan-2-ylpyridin-2-amine
CID 107081903
N-cyclopropyl-6-(ethylaminomethyl)-N-propylpyridazin-3-amine
CID 62279882
N-pentyl-N-propan-2-yl-2-(propylaminomethyl)pyridin-4-amine
CID 62292935
N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]-N-propan-2-ylpentan-1-amine
CID 106906306

Frequently Asked Questions

What is the IUPAC name of 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine?
The IUPAC name of 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine (CID 62294532) is 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine.
What is the SMILES notation for 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine?
The canonical SMILES for 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine is CCCCCN(c1ccc(CNCC)nn1)C(C)C.
What is the InChIKey of 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine?
The InChIKey is BHGVSRVWJVIJQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-5-7-8-11-19(13(3)4)15-10-9-14(17-18-15)12-16-6-2/h9-10,13,16H,5-8,11-12H2,1-4H3.
What are the key properties of 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine?
6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine has a molecular weight of 264.42 g/mol, XLogP of 2.99, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylaminomethyl)-N-pentyl-N-propan-2-ylpyridazin-3-amine is sourced from PubChem (CID 62294532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).