N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine

C11H22N4 — CID 114690406

IUPACN-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine
SMILESCCNC(CCc1cnnn1C)C(C)C
InChIInChI=1S/C11H22N4/c1-5-12-11(9(2)3)7-6-10-8-13-14-15(10)4/h8-9,11-12H,5-7H2,1-4H3
InChIKeyGBBNMQMZBCSLIB-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.38
Rot. Bonds6

About N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine

N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine (PubChem CID 114690406) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine
PubChem CID114690406
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC NameN-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine
SMILESCCNC(CCc1cnnn1C)C(C)C
InChIInChI=1S/C11H22N4/c1-5-12-11(9(2)3)7-6-10-8-13-14-15(10)4/h8-9,11-12H,5-7H2,1-4H3
InChIKeyGBBNMQMZBCSLIB-UHFFFAOYSA-N
XLogP1.38
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-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

(2S)-3-methyl-2-[(3-methyltriazol-4-yl)methylamino]butan-1-ol
CID 114986524
1-(3-methyltriazol-4-yl)-N-propylhexan-3-amine
CID 114690385
4-methyl-1-(3-phenyltriazol-4-yl)-N-propylpentan-3-amine
CID 114690410
N-ethyl-4-methyl-1-(1,3,5-trimethylpyrazol-4-yl)pentan-3-amine
CID 105078315
2-methyl-N-[2-(3-methyltriazol-4-yl)ethyl]propanamide
CID 155354741
N-ethyl-4-methyl-4-(3-methyltriazol-4-yl)pentan-2-amine
CID 114690474
1-ethylsulfanyl-N-[(3-methyltriazol-4-yl)methyl]propan-2-amine
CID 115682796
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-N-ethyl-4-methylpentan-3-amine
CID 114664314
1-(1-butan-2-ylpyrazol-3-yl)-N-ethyl-4-methylpentan-3-amine
CID 64783818
N-ethyl-4-methyl-1-pyridin-2-ylpentan-3-amine
CID 105078244
(3-methyltriazol-4-yl)methanol
CID 12654348
N-[(3-methyltriazol-4-yl)methyl]-1-thiophen-2-ylbutan-1-amine
CID 115682482

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine?
The IUPAC name of N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine (CID 114690406) is N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine.
What is the SMILES notation for N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine?
The canonical SMILES for N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine is CCNC(CCc1cnnn1C)C(C)C.
What is the InChIKey of N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine?
The InChIKey is GBBNMQMZBCSLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-5-12-11(9(2)3)7-6-10-8-13-14-15(10)4/h8-9,11-12H,5-7H2,1-4H3.
What are the key properties of N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine?
N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine has a molecular weight of 210.32 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-1-(3-methyltriazol-4-yl)pentan-3-amine is sourced from PubChem (CID 114690406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).