N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine

C16H25N5 — CID 60807826

IUPACN-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine
SMILESCCN(Cc1cn2c(C)cc(C)nc2n1)C1CCNCC1
InChIInChI=1S/C16H25N5/c1-4-20(15-5-7-17-8-6-15)10-14-11-21-13(3)9-12(2)18-16(21)19-14/h9,11,15,17H,4-8,10H2,1-3H3
InChIKeyWFVDKIWWIXGKOX-UHFFFAOYSA-N
MW287.41 g/mol
LogP1.92
Rot. Bonds4

About N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine

N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine (PubChem CID 60807826) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine
PubChem CID60807826
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC NameN-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine
SMILESCCN(Cc1cn2c(C)cc(C)nc2n1)C1CCNCC1
InChIInChI=1S/C16H25N5/c1-4-20(15-5-7-17-8-6-15)10-14-11-21-13(3)9-12(2)18-16(21)19-14/h9,11,15,17H,4-8,10H2,1-3H3
InChIKeyWFVDKIWWIXGKOX-UHFFFAOYSA-N
XLogP1.92
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine?
The IUPAC name of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine (CID 60807826) is N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine.
What is the SMILES notation for N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine?
The canonical SMILES for N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine is CCN(Cc1cn2c(C)cc(C)nc2n1)C1CCNCC1.
What is the InChIKey of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine?
The InChIKey is WFVDKIWWIXGKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-4-20(15-5-7-17-8-6-15)10-14-11-21-13(3)9-12(2)18-16(21)19-14/h9,11,15,17H,4-8,10H2,1-3H3.
What are the key properties of N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine?
N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine has a molecular weight of 287.41 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylpiperidin-4-amine is sourced from PubChem (CID 60807826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).