2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol

C15H22N4O — CID 102633037

IUPAC2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol
SMILESCN(c1nc2ccccn2c1CN)C1CCCCC1O
InChIInChI=1S/C15H22N4O/c1-18(11-6-2-3-7-13(11)20)15-12(10-16)19-9-5-4-8-14(19)17-15/h4-5,8-9,11,13,20H,2-3,6-7,10,16H2,1H3
InChIKeyHSOGZFZKUWCTQV-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.53
Rot. Bonds3

About 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol

2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol (PubChem CID 102633037) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol
PubChem CID102633037
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol
SMILESCN(c1nc2ccccn2c1CN)C1CCCCC1O
InChIInChI=1S/C15H22N4O/c1-18(11-6-2-3-7-13(11)20)15-12(10-16)19-9-5-4-8-14(19)17-15/h4-5,8-9,11,13,20H,2-3,6-7,10,16H2,1H3
InChIKeyHSOGZFZKUWCTQV-UHFFFAOYSA-N
XLogP1.53
TPSA66.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol (CID 102633037) is 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol is CN(c1nc2ccccn2c1CN)C1CCCCC1O.
What is the InChIKey of 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol?
The InChIKey is HSOGZFZKUWCTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-18(11-6-2-3-7-13(11)20)15-12(10-16)19-9-5-4-8-14(19)17-15/h4-5,8-9,11,13,20H,2-3,6-7,10,16H2,1H3.
What are the key properties of 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol?
2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol has a molecular weight of 274.37 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]cyclohexan-1-ol is sourced from PubChem (CID 102633037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).