N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine

C15H20N4 — CID 106571990

IUPACN-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine
SMILESCc1ccc(Cn2ccnc2NC2CCCC2)cn1
InChIInChI=1S/C15H20N4/c1-12-6-7-13(10-17-12)11-19-9-8-16-15(19)18-14-4-2-3-5-14/h6-10,14H,2-5,11H2,1H3,(H,16,18)
InChIKeyLWYOLALBAXLFDP-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.99
Rot. Bonds4

About N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine

N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine (PubChem CID 106571990) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine
PubChem CID106571990
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine
SMILESCc1ccc(Cn2ccnc2NC2CCCC2)cn1
InChIInChI=1S/C15H20N4/c1-12-6-7-13(10-17-12)11-19-9-8-16-15(19)18-14-4-2-3-5-14/h6-10,14H,2-5,11H2,1H3,(H,16,18)
InChIKeyLWYOLALBAXLFDP-UHFFFAOYSA-N
XLogP2.99
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine (CID 106571990) is N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine is Cc1ccc(Cn2ccnc2NC2CCCC2)cn1.
What is the InChIKey of N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine?
The InChIKey is LWYOLALBAXLFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-12-6-7-13(10-17-12)11-19-9-8-16-15(19)18-14-4-2-3-5-14/h6-10,14H,2-5,11H2,1H3,(H,16,18).
What are the key properties of N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine?
N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine has a molecular weight of 256.35 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-[(6-methyl-3-pyridinyl)methyl]imidazol-2-amine is sourced from PubChem (CID 106571990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).