4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine

C14H20N4 — CID 114718576

IUPAC4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine
SMILESCCC(C)C(C)n1cncc1-c1ccnc(N)c1
InChIInChI=1S/C14H20N4/c1-4-10(2)11(3)18-9-16-8-13(18)12-5-6-17-14(15)7-12/h5-11H,4H2,1-3H3,(H2,15,17)
InChIKeyYCLVKBITMKKQGP-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.13
Rot. Bonds4

About 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine

4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine (PubChem CID 114718576) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine
PubChem CID114718576
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine
SMILESCCC(C)C(C)n1cncc1-c1ccnc(N)c1
InChIInChI=1S/C14H20N4/c1-4-10(2)11(3)18-9-16-8-13(18)12-5-6-17-14(15)7-12/h5-11H,4H2,1-3H3,(H2,15,17)
InChIKeyYCLVKBITMKKQGP-UHFFFAOYSA-N
XLogP3.13
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[5-(2-amino-4-pyridinyl)imidazol-1-yl]propanoate
CID 114718853
4-[3-(4-ethylsulfanylbutan-2-yl)imidazol-4-yl]pyridin-2-amine
CID 114722647
4-[3-(2-methylbutyl)imidazol-4-yl]pyridin-2-amine
CID 114719950
4-[3-(1-pyridin-2-ylethyl)imidazol-4-yl]pyridin-2-amine
CID 114717900
4-[3-[1-(5-methylthiophen-2-yl)ethyl]imidazol-4-yl]pyridin-2-amine
CID 114719474
4-[3-(2,3,3-trimethylbutyl)imidazol-4-yl]pyridin-2-amine
CID 114721670
4-(3-pentylimidazol-4-yl)pyridin-2-amine
CID 114716246
ethyl 3-[5-(2-amino-4-pyridinyl)imidazol-1-yl]propanoate
CID 114719027
4-[3-(3-methylbut-2-enyl)imidazol-4-yl]pyridin-2-amine
CID 106194333
4-[3-[(6-methyl-3-pyridinyl)methyl]imidazol-4-yl]pyridin-2-amine
CID 114720279
4-[3-(1-propan-2-ylpyrazol-4-yl)imidazol-4-yl]pyridin-2-amine
CID 114720076
4-[3-(3-propan-2-ylphenyl)imidazol-4-yl]pyridin-2-amine
CID 114717854

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine (CID 114718576) is 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine is CCC(C)C(C)n1cncc1-c1ccnc(N)c1.
What is the InChIKey of 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine?
The InChIKey is YCLVKBITMKKQGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-4-10(2)11(3)18-9-16-8-13(18)12-5-6-17-14(15)7-12/h5-11H,4H2,1-3H3,(H2,15,17).
What are the key properties of 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine?
4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine has a molecular weight of 244.34 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3-methylpentan-2-yl)imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 114718576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).