N,N-diethyl-4,6-dipentyltriazin-5-amine

C17H32N4 — CID 134976654

IUPACN,N-diethyl-4,6-dipentyltriazin-5-amine
SMILESCCCCCc1nnnc(CCCCC)c1N(CC)CC
InChIInChI=1S/C17H32N4/c1-5-9-11-13-15-17(21(7-3)8-4)16(19-20-18-15)14-12-10-6-2/h5-14H2,1-4H3
InChIKeyRLWFWYLHNKVWCS-UHFFFAOYSA-N
MW292.47 g/mol
LogP4.18
Rot. Bonds11

About N,N-diethyl-4,6-dipentyltriazin-5-amine

N,N-diethyl-4,6-dipentyltriazin-5-amine (PubChem CID 134976654) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is N,N-diethyl-4,6-dipentyltriazin-5-amine.

Molecular Properties

Compound NameN,N-diethyl-4,6-dipentyltriazin-5-amine
PubChem CID134976654
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC NameN,N-diethyl-4,6-dipentyltriazin-5-amine
SMILESCCCCCc1nnnc(CCCCC)c1N(CC)CC
InChIInChI=1S/C17H32N4/c1-5-9-11-13-15-17(21(7-3)8-4)16(19-20-18-15)14-12-10-6-2/h5-14H2,1-4H3
InChIKeyRLWFWYLHNKVWCS-UHFFFAOYSA-N
XLogP4.18
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N,N-diethyl-4,6-dipentyltriazin-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-dipentyl-1,2,5-oxadiazole
CID 70008061
4,5,6-tripentyl-2-propylpyrimidine
CID 90692592
5-(4-pentylphenyl)pyrimidine
CID 56629303
N,N-diethyl-2-tetradecylaniline
CID 174968548
N,N-diethyl-2-heptadecylaniline
CID 175210337
2-propyl-4,5,6-tri(tetracosyl)pyrimidine
CID 91806969
4,5,6-tri(docosyl)-2-propylpyrimidine
CID 90898493
2-methyl-4,5,6-tripentylpyrimidine
CID 66935521
N,N-diethyl-2-octylaniline;hydrobromide
CID 175207974
N,N-diethyl-2-pentadecylaniline;hydrochloride
CID 174968496
N,N-diethyl-2-nonadecylaniline;hydrochloride
CID 175368767
4-pentyl-5-prop-2-enyltriazine
CID 68573903

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4,6-dipentyltriazin-5-amine?
The IUPAC name of N,N-diethyl-4,6-dipentyltriazin-5-amine (CID 134976654) is N,N-diethyl-4,6-dipentyltriazin-5-amine.
What is the SMILES notation for N,N-diethyl-4,6-dipentyltriazin-5-amine?
The canonical SMILES for N,N-diethyl-4,6-dipentyltriazin-5-amine is CCCCCc1nnnc(CCCCC)c1N(CC)CC.
What is the InChIKey of N,N-diethyl-4,6-dipentyltriazin-5-amine?
The InChIKey is RLWFWYLHNKVWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-5-9-11-13-15-17(21(7-3)8-4)16(19-20-18-15)14-12-10-6-2/h5-14H2,1-4H3.
What are the key properties of N,N-diethyl-4,6-dipentyltriazin-5-amine?
N,N-diethyl-4,6-dipentyltriazin-5-amine has a molecular weight of 292.47 g/mol, XLogP of 4.18, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4,6-dipentyltriazin-5-amine is sourced from PubChem (CID 134976654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).