N-(3-methylbut-2-en-2-yl)pyridin-3-amine

C10H14N2 — CID 58929048

IUPACN-(3-methylbut-2-en-2-yl)pyridin-3-amine
SMILESCC(C)=C(C)Nc1cccnc1
InChIInChI=1S/C10H14N2/c1-8(2)9(3)12-10-5-4-6-11-7-10/h4-7,12H,1-3H3
InChIKeyJCURKBIVJXXIFS-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.81
Rot. Bonds2

About N-(3-methylbut-2-en-2-yl)pyridin-3-amine

N-(3-methylbut-2-en-2-yl)pyridin-3-amine (PubChem CID 58929048) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-(3-methylbut-2-en-2-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-(3-methylbut-2-en-2-yl)pyridin-3-amine
PubChem CID58929048
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-(3-methylbut-2-en-2-yl)pyridin-3-amine
SMILESCC(C)=C(C)Nc1cccnc1
InChIInChI=1S/C10H14N2/c1-8(2)9(3)12-10-5-4-6-11-7-10/h4-7,12H,1-3H3
InChIKeyJCURKBIVJXXIFS-UHFFFAOYSA-N
XLogP2.81
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-methylbut-2-en-2-yl)pyridin-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

molecular hydrogen;N-pyridin-3-ylethanethioamide
CID 143306027
pyridin-3-ylthiourea
CID 2760515
N-(4-acetylphenyl)-N'-pyridin-3-yloxamide
CID 108514790
(5Z)-5-methyl-6-(pyridin-3-ylamino)hepta-1,5-dien-4-one
CID 143955611
ethane;N-methylpyridin-3-amine
CID 91430147
azane;N-methylpyridin-3-amine
CID 70247108
1-(4-methylphenyl)-3-pyridin-3-ylurea
CID 790714
1-(dimethylamino)-3-pyridin-3-ylurea
CID 123360253
3-acetamido-N-pyridin-3-ylpropanamide
CID 91801519
1,1-diethyl-3-pyridin-3-ylthiourea
CID 60640914
1-(6-methyl-3-pyridinyl)-3-pyridin-3-ylurea
CID 108865035
2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
CID 177434462

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbut-2-en-2-yl)pyridin-3-amine?
The IUPAC name of N-(3-methylbut-2-en-2-yl)pyridin-3-amine (CID 58929048) is N-(3-methylbut-2-en-2-yl)pyridin-3-amine.
What is the SMILES notation for N-(3-methylbut-2-en-2-yl)pyridin-3-amine?
The canonical SMILES for N-(3-methylbut-2-en-2-yl)pyridin-3-amine is CC(C)=C(C)Nc1cccnc1.
What is the InChIKey of N-(3-methylbut-2-en-2-yl)pyridin-3-amine?
The InChIKey is JCURKBIVJXXIFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-8(2)9(3)12-10-5-4-6-11-7-10/h4-7,12H,1-3H3.
What are the key properties of N-(3-methylbut-2-en-2-yl)pyridin-3-amine?
N-(3-methylbut-2-en-2-yl)pyridin-3-amine has a molecular weight of 162.24 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbut-2-en-2-yl)pyridin-3-amine is sourced from PubChem (CID 58929048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).