(3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine

C12H20N4 — CID 105476675

IUPAC(3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine
SMILESCn1cnc2c1C1(CCCC1)NC(CN)C2
InChIInChI=1S/C12H20N4/c1-16-8-14-10-6-9(7-13)15-12(11(10)16)4-2-3-5-12/h8-9,15H,2-7,13H2,1H3
InChIKeyCFTBYQQYBKCGRI-UHFFFAOYSA-N
MW220.32 g/mol
LogP0.66
Rot. Bonds1

About (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine

(3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine (PubChem CID 105476675) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine.

Molecular Properties

Compound Name(3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine
PubChem CID105476675
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name(3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine
SMILESCn1cnc2c1C1(CCCC1)NC(CN)C2
InChIInChI=1S/C12H20N4/c1-16-8-14-10-6-9(7-13)15-12(11(10)16)4-2-3-5-12/h8-9,15H,2-7,13H2,1H3
InChIKeyCFTBYQQYBKCGRI-UHFFFAOYSA-N
XLogP0.66
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine?
The IUPAC name of (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine (CID 105476675) is (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine.
What is the SMILES notation for (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine?
The canonical SMILES for (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine is Cn1cnc2c1C1(CCCC1)NC(CN)C2.
What is the InChIKey of (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine?
The InChIKey is CFTBYQQYBKCGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-16-8-14-10-6-9(7-13)15-12(11(10)16)4-2-3-5-12/h8-9,15H,2-7,13H2,1H3.
What are the key properties of (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine?
(3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine has a molecular weight of 220.32 g/mol, XLogP of 0.66, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylspiro[6,7-dihydro-5H-imidazo[4,5-c]pyridine-4,1'-cyclopentane]-6-yl)methanamine is sourced from PubChem (CID 105476675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).