N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine

C15H27N3 — CID 62286174

IUPACN-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine
SMILESCCCCN(CC)c1cccc(CNCCC)n1
InChIInChI=1S/C15H27N3/c1-4-7-12-18(6-3)15-10-8-9-14(17-15)13-16-11-5-2/h8-10,16H,4-7,11-13H2,1-3H3
InChIKeyFUEZDUUUJFPKFV-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.21
Rot. Bonds9

About N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine

N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine (PubChem CID 62286174) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine
PubChem CID62286174
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC NameN-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine
SMILESCCCCN(CC)c1cccc(CNCCC)n1
InChIInChI=1S/C15H27N3/c1-4-7-12-18(6-3)15-10-8-9-14(17-15)13-16-11-5-2/h8-10,16H,4-7,11-13H2,1-3H3
InChIKeyFUEZDUUUJFPKFV-UHFFFAOYSA-N
XLogP3.21
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N-ethyl-5-(propylaminomethyl)pyrazin-2-amine
CID 107378913
N-ethyl-6-(methylaminomethyl)-N-propylpyridin-2-amine
CID 62280053
N-[[6-(propylaminomethyl)-2-pyridinyl]methyl]propan-1-amine
CID 11501840
N-butyl-5-chloro-N-ethyl-6-(propylaminomethyl)pyridin-2-amine
CID 55054566
6-N-butyl-6-N-ethyl-2-N-methylpyridine-2,6-diamine
CID 80754350
N-butyl-N-ethyl-2-(propylaminomethyl)pyridin-4-amine
CID 62286341
N-cyclopentyl-N-methyl-6-(propylaminomethyl)pyridin-2-amine
CID 62278994
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridin-2-amine
CID 62288685
6-N-[3-(dimethylamino)propyl]-6-N-ethyl-2-N-propylpyridine-2,6-diamine
CID 102998825
6-(ethylaminomethyl)-N-methyl-N-propylpyridin-2-amine
CID 62279844
N-[(2-bromophenyl)methyl]-N-methyl-6-(propylaminomethyl)pyridin-2-amine
CID 62292841
N,N-dimethyl-3-[[6-(propylaminomethyl)-2-pyridinyl]oxy]propan-1-amine
CID 62298223

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine?
The IUPAC name of N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine (CID 62286174) is N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine.
What is the SMILES notation for N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine?
The canonical SMILES for N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine is CCCCN(CC)c1cccc(CNCCC)n1.
What is the InChIKey of N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine?
The InChIKey is FUEZDUUUJFPKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-4-7-12-18(6-3)15-10-8-9-14(17-15)13-16-11-5-2/h8-10,16H,4-7,11-13H2,1-3H3.
What are the key properties of N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine?
N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine has a molecular weight of 249.40 g/mol, XLogP of 3.21, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethyl-6-(propylaminomethyl)pyridin-2-amine is sourced from PubChem (CID 62286174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).