N-ethyl-3-pyrimidin-2-ylbutan-2-amine

C10H17N3 — CID 63199557

IUPACN-ethyl-3-pyrimidin-2-ylbutan-2-amine
SMILESCCNC(C)C(C)c1ncccn1
InChIInChI=1S/C10H17N3/c1-4-11-9(3)8(2)10-12-6-5-7-13-10/h5-9,11H,4H2,1-3H3
InChIKeyHUXBCTDRHXHSGC-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.58
Rot. Bonds4

About N-ethyl-3-pyrimidin-2-ylbutan-2-amine

N-ethyl-3-pyrimidin-2-ylbutan-2-amine (PubChem CID 63199557) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-ethyl-3-pyrimidin-2-ylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-pyrimidin-2-ylbutan-2-amine
PubChem CID63199557
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-ethyl-3-pyrimidin-2-ylbutan-2-amine
SMILESCCNC(C)C(C)c1ncccn1
InChIInChI=1S/C10H17N3/c1-4-11-9(3)8(2)10-12-6-5-7-13-10/h5-9,11H,4H2,1-3H3
InChIKeyHUXBCTDRHXHSGC-UHFFFAOYSA-N
XLogP1.58
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-3-pyrimidin-2-ylbutan-2-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

N-ethyl-3-(5-nitropyrimidin-2-yl)butan-2-amine
CID 63199611
2-(3-methylbutan-2-yl)pyrimidine
CID 139342310
N-ethyl-3-quinolin-7-ylbutan-2-amine
CID 81224003
N-ethyl-3-(1-methylimidazol-2-yl)butan-2-amine
CID 63200047
3-(5-methylpyrimidin-2-yl)-N-propylbutan-2-amine
CID 63206017
3-(3-benzyl-1,2,4-oxadiazol-5-yl)-N-ethylbutan-2-amine
CID 63347609
3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]-N-ethylbutan-2-amine
CID 65403344
3-(5-bromopyrimidin-2-yl)-N-propylbutan-2-amine
CID 63873435
N-ethyl-3-(3-propyl-1,2,4-oxadiazol-5-yl)butan-2-amine
CID 63348667
N-ethyl-3-(3-methylpyrazin-2-yl)pentan-2-amine
CID 83062645
3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-ethylbutan-2-amine
CID 63347961
N-[cycloheptyl(pyrimidin-2-yl)methyl]ethanamine
CID 82932188

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-pyrimidin-2-ylbutan-2-amine?
The IUPAC name of N-ethyl-3-pyrimidin-2-ylbutan-2-amine (CID 63199557) is N-ethyl-3-pyrimidin-2-ylbutan-2-amine.
What is the SMILES notation for N-ethyl-3-pyrimidin-2-ylbutan-2-amine?
The canonical SMILES for N-ethyl-3-pyrimidin-2-ylbutan-2-amine is CCNC(C)C(C)c1ncccn1.
What is the InChIKey of N-ethyl-3-pyrimidin-2-ylbutan-2-amine?
The InChIKey is HUXBCTDRHXHSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-4-11-9(3)8(2)10-12-6-5-7-13-10/h5-9,11H,4H2,1-3H3.
What are the key properties of N-ethyl-3-pyrimidin-2-ylbutan-2-amine?
N-ethyl-3-pyrimidin-2-ylbutan-2-amine has a molecular weight of 179.27 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-pyrimidin-2-ylbutan-2-amine is sourced from PubChem (CID 63199557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).