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

C15H20N4 — CID 107421498

IUPAC4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine
SMILESCC1CCCC1Cn1cncc1-c1ccnc(N)c1
InChIInChI=1S/C15H20N4/c1-11-3-2-4-13(11)9-19-10-17-8-14(19)12-5-6-18-15(16)7-12/h5-8,10-11,13H,2-4,9H2,1H3,(H2,16,18)
InChIKeyORZAKWJZBPFCNE-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.96
Rot. Bonds3

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

4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine (PubChem CID 107421498) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine
PubChem CID107421498
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine
SMILESCC1CCCC1Cn1cncc1-c1ccnc(N)c1
InChIInChI=1S/C15H20N4/c1-11-3-2-4-13(11)9-19-10-17-8-14(19)12-5-6-18-15(16)7-12/h5-8,10-11,13H,2-4,9H2,1H3,(H2,16,18)
InChIKeyORZAKWJZBPFCNE-UHFFFAOYSA-N
XLogP2.96
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine?
The IUPAC name of 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine (CID 107421498) is 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine?
The canonical SMILES for 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine is CC1CCCC1Cn1cncc1-c1ccnc(N)c1.
What is the InChIKey of 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine?
The InChIKey is ORZAKWJZBPFCNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-11-3-2-4-13(11)9-19-10-17-8-14(19)12-5-6-18-15(16)7-12/h5-8,10-11,13H,2-4,9H2,1H3,(H2,16,18).
What are the key properties of 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine?
4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(2-methylcyclopentyl)methyl]imidazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 107421498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).